Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30684
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 30684 1
2 '2D 1H-13C HSQC aliphatic' . . . 30684 1
3 '3D CBCA(CO)NH' . . . 30684 1
4 '3D HNCACB' . . . 30684 1
5 '2D 1H-13C HSQC aliphatic' . . . 30684 1
6 '3D 1H-15N NOESY' . . . 30684 1
7 '3D HCCH-TOCSY' . . . 30684 1
8 '3D H(CCO)NH' . . . 30684 1
9 '3D C(CO)NH' . . . 30684 1
10 '3D HNCO' . . . 30684 1
11 '3D 1H-13C NOESY aliphatic' . . . 30684 1
12 '3D 1H-13C NOESY aromatic' . . . 30684 1
13 '2D 1H-15N IPAP HSQC' . . . 30684 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 21 21 GLY H H 1 8.184 . . 1 . . 7 . A 21 GLY H . 30684 1
2 . 1 . 1 21 21 GLY N N 15 108.757 . . 1 . . 8 . A 21 GLY N . 30684 1
3 . 1 . 1 26 26 PRO HA H 1 4.455 . . 1 . . 238 . A 26 PRO HA . 30684 1
4 . 1 . 1 26 26 PRO HB2 H 1 1.889 . . 2 . . 243 . A 26 PRO HB2 . 30684 1
5 . 1 . 1 26 26 PRO HB3 H 1 1.849 . . 2 . . 244 . A 26 PRO HB3 . 30684 1
6 . 1 . 1 26 26 PRO HG2 H 1 2.190 . . 2 . . 241 . A 26 PRO HG2 . 30684 1
7 . 1 . 1 26 26 PRO HG3 H 1 2.199 . . 2 . . 242 . A 26 PRO HG3 . 30684 1
8 . 1 . 1 26 26 PRO HD2 H 1 3.451 . . 1 . . 239 . A 26 PRO HD2 . 30684 1
9 . 1 . 1 26 26 PRO HD3 H 1 3.451 . . 1 . . 240 . A 26 PRO HD3 . 30684 1
10 . 1 . 1 26 26 PRO CA C 13 62.280 . . 1 . . 108 . A 26 PRO CA . 30684 1
11 . 1 . 1 26 26 PRO CB C 13 33.165 . . 1 . . 109 . A 26 PRO CB . 30684 1
12 . 1 . 1 26 26 PRO CG C 13 26.378 . . 1 . . 437 . A 26 PRO CG . 30684 1
13 . 1 . 1 27 27 PHE H H 1 8.752 0.004 . 1 . . 79 . A 27 PHE H . 30684 1
14 . 1 . 1 27 27 PHE HA H 1 5.366 0.014 . 1 . . 245 . A 27 PHE HA . 30684 1
15 . 1 . 1 27 27 PHE HB2 H 1 3.652 0.021 . 2 . . 246 . A 27 PHE HB2 . 30684 1
16 . 1 . 1 27 27 PHE HB3 H 1 2.896 0.009 . 2 . . 247 . A 27 PHE HB3 . 30684 1
17 . 1 . 1 27 27 PHE HD1 H 1 7.185 0.009 . 1 . . 435 . A 27 PHE HD1 . 30684 1
18 . 1 . 1 27 27 PHE HD2 H 1 7.185 0.009 . 1 . . 435 . A 27 PHE HD2 . 30684 1
19 . 1 . 1 27 27 PHE C C 13 176.089 . . 1 . . 476 . A 27 PHE C . 30684 1
20 . 1 . 1 27 27 PHE CA C 13 56.857 . . 1 . . 107 . A 27 PHE CA . 30684 1
21 . 1 . 1 27 27 PHE CB C 13 41.675 0.153 . 1 . . 106 . A 27 PHE CB . 30684 1
22 . 1 . 1 27 27 PHE N N 15 120.523 . . 1 . . 80 . A 27 PHE N . 30684 1
23 . 1 . 1 28 28 CYS H H 1 9.138 0.005 . 1 . . 31 . A 28 CYS H . 30684 1
24 . 1 . 1 28 28 CYS HA H 1 4.264 . . 1 . . 562 . A 28 CYS HA . 30684 1
25 . 1 . 1 28 28 CYS HB2 H 1 3.047 0.024 . 2 . . 248 . A 28 CYS HB2 . 30684 1
26 . 1 . 1 28 28 CYS HB3 H 1 2.767 . . 2 . . 249 . A 28 CYS HB3 . 30684 1
27 . 1 . 1 28 28 CYS C C 13 173.510 . . 1 . . 477 . A 28 CYS C . 30684 1
28 . 1 . 1 28 28 CYS CA C 13 55.940 . . 1 . . 104 . A 28 CYS CA . 30684 1
29 . 1 . 1 28 28 CYS CB C 13 27.825 . . 1 . . 105 . A 28 CYS CB . 30684 1
30 . 1 . 1 28 28 CYS N N 15 115.996 0.0 . 1 . . 32 . A 28 CYS N . 30684 1
31 . 1 . 1 29 29 GLY H H 1 7.626 0.009 . 1 . . 5 . A 29 GLY H . 30684 1
32 . 1 . 1 29 29 GLY HA2 H 1 4.475 0.011 . 2 . . 250 . A 29 GLY HA2 . 30684 1
33 . 1 . 1 29 29 GLY HA3 H 1 3.941 0.003 . 2 . . 251 . A 29 GLY HA3 . 30684 1
34 . 1 . 1 29 29 GLY C C 13 172.020 . . 1 . . 528 . A 29 GLY C . 30684 1
35 . 1 . 1 29 29 GLY CA C 13 44.668 0.0 . 1 . . 95 . A 29 GLY CA . 30684 1
36 . 1 . 1 29 29 GLY N N 15 109.065 0.0 . 1 . . 6 . A 29 GLY N . 30684 1
37 . 1 . 1 30 30 ARG H H 1 8.759 0.01 . 1 . . 81 . A 30 ARG H . 30684 1
38 . 1 . 1 30 30 ARG HA H 1 5.441 0.009 . 1 . . 252 . A 30 ARG HA . 30684 1
39 . 1 . 1 30 30 ARG HB2 H 1 1.648 0.019 . 2 . . 254 . A 30 ARG HB2 . 30684 1
40 . 1 . 1 30 30 ARG HB3 H 1 1.598 0.014 . 2 . . 255 . A 30 ARG HB3 . 30684 1
41 . 1 . 1 30 30 ARG HD2 H 1 3.044 0.01 . 2 . . 253 . A 30 ARG HD2 . 30684 1
42 . 1 . 1 30 30 ARG HD3 H 1 3.077 0.006 . 2 . . 657 . A 30 ARG HD3 . 30684 1
43 . 1 . 1 30 30 ARG C C 13 174.255 . . 1 . . 478 . A 30 ARG C . 30684 1
44 . 1 . 1 30 30 ARG CA C 13 55.004 . . 1 . . 96 . A 30 ARG CA . 30684 1
45 . 1 . 1 30 30 ARG CB C 13 35.191 . . 1 . . 97 . A 30 ARG CB . 30684 1
46 . 1 . 1 30 30 ARG CG C 13 27.910 . . 1 . . 439 . A 30 ARG CG . 30684 1
47 . 1 . 1 30 30 ARG CD C 13 44.049 . . 1 . . 438 . A 30 ARG CD . 30684 1
48 . 1 . 1 30 30 ARG N N 15 119.670 0.0 . 1 . . 82 . A 30 ARG N . 30684 1
49 . 1 . 1 31 31 ALA H H 1 9.211 0.011 . 1 . . 45 . A 31 ALA H . 30684 1
50 . 1 . 1 31 31 ALA HA H 1 5.352 0.01 . 1 . . 563 . A 31 ALA HA . 30684 1
51 . 1 . 1 31 31 ALA HB1 H 1 1.223 0.013 . 1 . . 256 . A 31 ALA HB1 . 30684 1
52 . 1 . 1 31 31 ALA HB2 H 1 1.223 0.013 . 1 . . 256 . A 31 ALA HB2 . 30684 1
53 . 1 . 1 31 31 ALA HB3 H 1 1.223 0.013 . 1 . . 256 . A 31 ALA HB3 . 30684 1
54 . 1 . 1 31 31 ALA C C 13 174.140 . . 1 . . 479 . A 31 ALA C . 30684 1
55 . 1 . 1 31 31 ALA CA C 13 49.814 . . 1 . . 98 . A 31 ALA CA . 30684 1
56 . 1 . 1 31 31 ALA CB C 13 22.129 0.01 . 1 . . 596 . A 31 ALA CB . 30684 1
57 . 1 . 1 31 31 ALA N N 15 123.551 0.0 . 1 . . 46 . A 31 ALA N . 30684 1
58 . 1 . 1 32 32 ARG H H 1 9.201 0.014 . 1 . . 43 . A 32 ARG H . 30684 1
59 . 1 . 1 32 32 ARG HA H 1 5.258 0.017 . 1 . . 257 . A 32 ARG HA . 30684 1
60 . 1 . 1 32 32 ARG HB2 H 1 1.515 0.006 . 2 . . 658 . A 32 ARG HB2 . 30684 1
61 . 1 . 1 32 32 ARG HB3 H 1 1.883 0.011 . 2 . . 660 . A 32 ARG HB3 . 30684 1
62 . 1 . 1 32 32 ARG HG2 H 1 1.889 . . 2 . . 259 . A 32 ARG HG2 . 30684 1
63 . 1 . 1 32 32 ARG HG3 H 1 1.883 0.004 . 2 . . 260 . A 32 ARG HG3 . 30684 1
64 . 1 . 1 32 32 ARG HD2 H 1 3.245 0.004 . 2 . . 258 . A 32 ARG HD2 . 30684 1
65 . 1 . 1 32 32 ARG HD3 H 1 3.230 0.005 . 2 . . 659 . A 32 ARG HD3 . 30684 1
66 . 1 . 1 32 32 ARG C C 13 176.519 . . 1 . . 480 . A 32 ARG C . 30684 1
67 . 1 . 1 32 32 ARG CA C 13 53.717 0.185 . 1 . . 100 . A 32 ARG CA . 30684 1
68 . 1 . 1 32 32 ARG CB C 13 32.819 . . 1 . . 99 . A 32 ARG CB . 30684 1
69 . 1 . 1 32 32 ARG CG C 13 27.321 . . 1 . . 441 . A 32 ARG CG . 30684 1
70 . 1 . 1 32 32 ARG CD C 13 43.224 0.0 . 1 . . 440 . A 32 ARG CD . 30684 1
71 . 1 . 1 32 32 ARG N N 15 121.985 0.104 . 1 . . 44 . A 32 ARG N . 30684 1
72 . 1 . 1 33 33 VAL H H 1 9.421 0.011 . 1 . . 51 . A 33 VAL H . 30684 1
73 . 1 . 1 33 33 VAL HA H 1 3.874 0.007 . 1 . . 263 . A 33 VAL HA . 30684 1
74 . 1 . 1 33 33 VAL HB H 1 2.187 0.007 . 1 . . 262 . A 33 VAL HB . 30684 1
75 . 1 . 1 33 33 VAL HG11 H 1 0.677 0.019 . 2 . . 261 . A 33 VAL HG11 . 30684 1
76 . 1 . 1 33 33 VAL HG12 H 1 0.677 0.019 . 2 . . 261 . A 33 VAL HG12 . 30684 1
77 . 1 . 1 33 33 VAL HG13 H 1 0.677 0.019 . 2 . . 261 . A 33 VAL HG13 . 30684 1
78 . 1 . 1 33 33 VAL HG21 H 1 0.776 0.019 . 2 . . 612 . A 33 VAL HG21 . 30684 1
79 . 1 . 1 33 33 VAL HG22 H 1 0.776 0.019 . 2 . . 612 . A 33 VAL HG22 . 30684 1
80 . 1 . 1 33 33 VAL HG23 H 1 0.776 0.019 . 2 . . 612 . A 33 VAL HG23 . 30684 1
81 . 1 . 1 33 33 VAL C C 13 176.662 . . 1 . . 481 . A 33 VAL C . 30684 1
82 . 1 . 1 33 33 VAL CA C 13 63.281 0.0 . 1 . . 103 . A 33 VAL CA . 30684 1
83 . 1 . 1 33 33 VAL CB C 13 32.193 . . 1 . . 101 . A 33 VAL CB . 30684 1
84 . 1 . 1 33 33 VAL CG1 C 13 23.186 . . 2 . . 442 . A 33 VAL CG1 . 30684 1
85 . 1 . 1 33 33 VAL CG2 C 13 23.493 0.0 . 2 . . 613 . A 33 VAL CG2 . 30684 1
86 . 1 . 1 33 33 VAL N N 15 131.463 0.064 . 1 . . 52 . A 33 VAL N . 30684 1
87 . 1 . 1 34 34 HIS H H 1 8.905 0.011 . 1 . . 196 . A 34 HIS H . 30684 1
88 . 1 . 1 34 34 HIS HA H 1 5.099 0.006 . 1 . . 661 . A 34 HIS HA . 30684 1
89 . 1 . 1 34 34 HIS HB2 H 1 3.304 0.017 . 2 . . 264 . A 34 HIS HB2 . 30684 1
90 . 1 . 1 34 34 HIS HB3 H 1 2.996 0.014 . 2 . . 265 . A 34 HIS HB3 . 30684 1
91 . 1 . 1 34 34 HIS HD1 H 1 6.862 0.02 . 1 . . 544 . A 34 HIS HD1 . 30684 1
92 . 1 . 1 34 34 HIS HD2 H 1 6.881 0.019 . 1 . . 436 . A 34 HIS HD2 . 30684 1
93 . 1 . 1 34 34 HIS C C 13 175.086 . . 1 . . 529 . A 34 HIS C . 30684 1
94 . 1 . 1 34 34 HIS CA C 13 54.925 . . 1 . . 112 . A 34 HIS CA . 30684 1
95 . 1 . 1 34 34 HIS CB C 13 32.363 0.0 . 1 . . 113 . A 34 HIS CB . 30684 1
96 . 1 . 1 34 34 HIS CD2 C 13 119.723 . . 1 . . 545 . A 34 HIS CD2 . 30684 1
97 . 1 . 1 34 34 HIS N N 15 125.251 0.013 . 1 . . 197 . A 34 HIS N . 30684 1
98 . 1 . 1 35 35 THR H H 1 7.084 0.01 . 1 . . 13 . A 35 THR H . 30684 1
99 . 1 . 1 35 35 THR HA H 1 4.475 0.006 . 1 . . 266 . A 35 THR HA . 30684 1
100 . 1 . 1 35 35 THR HB H 1 3.829 0.009 . 1 . . 267 . A 35 THR HB . 30684 1
101 . 1 . 1 35 35 THR HG21 H 1 1.282 0.015 . 1 . . 599 . A 35 THR HG21 . 30684 1
102 . 1 . 1 35 35 THR HG22 H 1 1.282 0.015 . 1 . . 599 . A 35 THR HG22 . 30684 1
103 . 1 . 1 35 35 THR HG23 H 1 1.282 0.015 . 1 . . 599 . A 35 THR HG23 . 30684 1
104 . 1 . 1 35 35 THR C C 13 169.985 . . 1 . . 482 . A 35 THR C . 30684 1
105 . 1 . 1 35 35 THR CA C 13 62.673 0.0 . 1 . . 111 . A 35 THR CA . 30684 1
106 . 1 . 1 35 35 THR CB C 13 74.145 0.001 . 1 . . 110 . A 35 THR CB . 30684 1
107 . 1 . 1 35 35 THR CG2 C 13 20.258 0.002 . 1 . . 600 . A 35 THR CG2 . 30684 1
108 . 1 . 1 35 35 THR N N 15 121.810 0.0 . 1 . . 14 . A 35 THR N . 30684 1
109 . 1 . 1 36 36 ASP H H 1 8.084 0.01 . 1 . . 71 . A 36 ASP H . 30684 1
110 . 1 . 1 36 36 ASP HA H 1 4.234 0.012 . 1 . . 268 . A 36 ASP HA . 30684 1
111 . 1 . 1 36 36 ASP HB2 H 1 2.659 0.026 . 2 . . 269 . A 36 ASP HB2 . 30684 1
112 . 1 . 1 36 36 ASP HB3 H 1 2.495 0.004 . 2 . . 270 . A 36 ASP HB3 . 30684 1
113 . 1 . 1 36 36 ASP C C 13 175.602 . . 1 . . 483 . A 36 ASP C . 30684 1
114 . 1 . 1 36 36 ASP CA C 13 54.684 . . 1 . . 114 . A 36 ASP CA . 30684 1
115 . 1 . 1 36 36 ASP CB C 13 41.410 0.0 . 1 . . 115 . A 36 ASP CB . 30684 1
116 . 1 . 1 36 36 ASP N N 15 122.255 0.0 . 1 . . 72 . A 36 ASP N . 30684 1
117 . 1 . 1 37 37 PHE H H 1 8.247 0.019 . 1 . . 93 . A 37 PHE H . 30684 1
118 . 1 . 1 37 37 PHE HA H 1 4.362 0.016 . 1 . . 271 . A 37 PHE HA . 30684 1
119 . 1 . 1 37 37 PHE HB2 H 1 2.375 0.018 . 2 . . 272 . A 37 PHE HB2 . 30684 1
120 . 1 . 1 37 37 PHE HB3 H 1 2.278 0.019 . 2 . . 273 . A 37 PHE HB3 . 30684 1
121 . 1 . 1 37 37 PHE HD1 H 1 7.140 0.024 . 1 . . 554 . A 37 PHE HD1 . 30684 1
122 . 1 . 1 37 37 PHE HD2 H 1 7.140 0.024 . 1 . . 554 . A 37 PHE HD2 . 30684 1
123 . 1 . 1 37 37 PHE HE1 H 1 6.911 0.011 . 1 . . 548 . A 37 PHE HE1 . 30684 1
124 . 1 . 1 37 37 PHE HE2 H 1 6.911 0.011 . 1 . . 548 . A 37 PHE HE2 . 30684 1
125 . 1 . 1 37 37 PHE C C 13 172.880 . . 1 . . 484 . A 37 PHE C . 30684 1
126 . 1 . 1 37 37 PHE CA C 13 59.189 . . 1 . . 116 . A 37 PHE CA . 30684 1
127 . 1 . 1 37 37 PHE CB C 13 40.859 . . 1 . . 117 . A 37 PHE CB . 30684 1
128 . 1 . 1 37 37 PHE CD1 C 13 132.149 . . 1 . . 556 . A 37 PHE CD1 . 30684 1
129 . 1 . 1 37 37 PHE CD2 C 13 132.149 . . 1 . . 556 . A 37 PHE CD2 . 30684 1
130 . 1 . 1 37 37 PHE CE1 C 13 133.038 . . 1 . . 549 . A 37 PHE CE1 . 30684 1
131 . 1 . 1 37 37 PHE CE2 C 13 133.038 . . 1 . . 549 . A 37 PHE CE2 . 30684 1
132 . 1 . 1 37 37 PHE N N 15 119.191 0.0 . 1 . . 94 . A 37 PHE N . 30684 1
133 . 1 . 1 38 38 THR H H 1 7.791 0.007 . 1 . . 61 . A 38 THR H . 30684 1
134 . 1 . 1 38 38 THR HA H 1 4.469 0.003 . 1 . . 675 . A 38 THR HA . 30684 1
135 . 1 . 1 38 38 THR HB H 1 3.669 0.009 . 1 . . 564 . A 38 THR HB . 30684 1
136 . 1 . 1 38 38 THR HG21 H 1 1.052 0.005 . 1 . . 605 . A 38 THR HG21 . 30684 1
137 . 1 . 1 38 38 THR HG22 H 1 1.052 0.005 . 1 . . 605 . A 38 THR HG22 . 30684 1
138 . 1 . 1 38 38 THR HG23 H 1 1.052 0.005 . 1 . . 605 . A 38 THR HG23 . 30684 1
139 . 1 . 1 38 38 THR CA C 13 58.277 0.089 . 1 . . 118 . A 38 THR CA . 30684 1
140 . 1 . 1 38 38 THR CB C 13 70.018 0.014 . 1 . . 119 . A 38 THR CB . 30684 1
141 . 1 . 1 38 38 THR CG2 C 13 21.618 0.008 . 1 . . 606 . A 38 THR CG2 . 30684 1
142 . 1 . 1 38 38 THR N N 15 125.814 . . 1 . . 62 . A 38 THR N . 30684 1
143 . 1 . 1 39 39 PRO HA H 1 4.244 0.005 . 1 . . 274 . A 39 PRO HA . 30684 1
144 . 1 . 1 39 39 PRO HB2 H 1 1.794 0.005 . 2 . . 276 . A 39 PRO HB2 . 30684 1
145 . 1 . 1 39 39 PRO HB3 H 1 1.760 . . 2 . . 280 . A 39 PRO HB3 . 30684 1
146 . 1 . 1 39 39 PRO HG2 H 1 2.410 0.013 . 2 . . 277 . A 39 PRO HG2 . 30684 1
147 . 1 . 1 39 39 PRO HG3 H 1 2.164 0.011 . 2 . . 278 . A 39 PRO HG3 . 30684 1
148 . 1 . 1 39 39 PRO HD2 H 1 3.613 . . 1 . . 275 . A 39 PRO HD2 . 30684 1
149 . 1 . 1 39 39 PRO HD3 H 1 3.613 . . 1 . . 279 . A 39 PRO HD3 . 30684 1
150 . 1 . 1 39 39 PRO C C 13 176.261 . . 1 . . 485 . A 39 PRO C . 30684 1
151 . 1 . 1 39 39 PRO CA C 13 61.691 0.241 . 1 . . 200 . A 39 PRO CA . 30684 1
152 . 1 . 1 39 39 PRO CB C 13 32.760 . . 1 . . 201 . A 39 PRO CB . 30684 1
153 . 1 . 1 39 39 PRO CG C 13 26.682 . . 1 . . 444 . A 39 PRO CG . 30684 1
154 . 1 . 1 39 39 PRO CD C 13 51.538 . . 1 . . 445 . A 39 PRO CD . 30684 1
155 . 1 . 1 40 40 SER H H 1 9.055 0.01 . 1 . . 35 . A 40 SER H . 30684 1
156 . 1 . 1 40 40 SER HA H 1 4.115 . . 1 . . 432 . A 40 SER HA . 30684 1
157 . 1 . 1 40 40 SER HB2 H 1 3.851 0.009 . 2 . . 433 . A 40 SER HB2 . 30684 1
158 . 1 . 1 40 40 SER HB3 H 1 3.826 0.021 . 2 . . 434 . A 40 SER HB3 . 30684 1
159 . 1 . 1 40 40 SER CA C 13 56.907 . . 1 . . 198 . A 40 SER CA . 30684 1
160 . 1 . 1 40 40 SER CB C 13 63.274 . . 1 . . 199 . A 40 SER CB . 30684 1
161 . 1 . 1 40 40 SER N N 15 118.957 0.0 . 1 . . 36 . A 40 SER N . 30684 1
162 . 1 . 1 41 41 PRO HA H 1 4.187 0.009 . 1 . . 281 . A 41 PRO HA . 30684 1
163 . 1 . 1 41 41 PRO HB2 H 1 1.771 . . 2 . . 286 . A 41 PRO HB2 . 30684 1
164 . 1 . 1 41 41 PRO HB3 H 1 1.373 . . 2 . . 287 . A 41 PRO HB3 . 30684 1
165 . 1 . 1 41 41 PRO HG2 H 1 2.143 . . 2 . . 284 . A 41 PRO HG2 . 30684 1
166 . 1 . 1 41 41 PRO HG3 H 1 1.850 . . 2 . . 285 . A 41 PRO HG3 . 30684 1
167 . 1 . 1 41 41 PRO HD2 H 1 3.790 . . 2 . . 282 . A 41 PRO HD2 . 30684 1
168 . 1 . 1 41 41 PRO HD3 H 1 3.613 . . 2 . . 283 . A 41 PRO HD3 . 30684 1
169 . 1 . 1 41 41 PRO C C 13 176.691 . . 1 . . 486 . A 41 PRO C . 30684 1
170 . 1 . 1 41 41 PRO CA C 13 64.715 . . 1 . . 192 . A 41 PRO CA . 30684 1
171 . 1 . 1 41 41 PRO CB C 13 31.559 . . 1 . . 193 . A 41 PRO CB . 30684 1
172 . 1 . 1 41 41 PRO CG C 13 27.389 . . 1 . . 447 . A 41 PRO CG . 30684 1
173 . 1 . 1 41 41 PRO CD C 13 50.832 . . 1 . . 446 . A 41 PRO CD . 30684 1
174 . 1 . 1 42 42 TYR H H 1 7.370 0.008 . 1 . . 190 . A 42 TYR H . 30684 1
175 . 1 . 1 42 42 TYR HA H 1 4.509 0.007 . 1 . . 290 . A 42 TYR HA . 30684 1
176 . 1 . 1 42 42 TYR HB2 H 1 3.284 0.015 . 2 . . 288 . A 42 TYR HB2 . 30684 1
177 . 1 . 1 42 42 TYR HB3 H 1 2.810 0.008 . 2 . . 289 . A 42 TYR HB3 . 30684 1
178 . 1 . 1 42 42 TYR HD1 H 1 7.103 0.019 . 1 . . 555 . A 42 TYR HD1 . 30684 1
179 . 1 . 1 42 42 TYR HD2 H 1 7.103 0.019 . 1 . . 555 . A 42 TYR HD2 . 30684 1
180 . 1 . 1 42 42 TYR HE1 H 1 6.870 0.002 . 1 . . 558 . A 42 TYR HE1 . 30684 1
181 . 1 . 1 42 42 TYR HE2 H 1 6.870 0.002 . 1 . . 558 . A 42 TYR HE2 . 30684 1
182 . 1 . 1 42 42 TYR C C 13 175.545 . . 1 . . 487 . A 42 TYR C . 30684 1
183 . 1 . 1 42 42 TYR CA C 13 57.387 . . 1 . . 120 . A 42 TYR CA . 30684 1
184 . 1 . 1 42 42 TYR CB C 13 37.694 . . 1 . . 121 . A 42 TYR CB . 30684 1
185 . 1 . 1 42 42 TYR CD1 C 13 133.277 . . 1 . . 557 . A 42 TYR CD1 . 30684 1
186 . 1 . 1 42 42 TYR CD2 C 13 133.277 . . 1 . . 557 . A 42 TYR CD2 . 30684 1
187 . 1 . 1 42 42 TYR CE1 C 13 118.421 . . 1 . . 559 . A 42 TYR CE1 . 30684 1
188 . 1 . 1 42 42 TYR CE2 C 13 118.421 . . 1 . . 559 . A 42 TYR CE2 . 30684 1
189 . 1 . 1 42 42 TYR N N 15 113.224 . . 1 . . 191 . A 42 TYR N . 30684 1
190 . 1 . 1 43 43 ASP H H 1 7.610 0.007 . 1 . . 17 . A 43 ASP H . 30684 1
191 . 1 . 1 43 43 ASP HA H 1 4.961 0.003 . 1 . . 291 . A 43 ASP HA . 30684 1
192 . 1 . 1 43 43 ASP HB2 H 1 3.137 0.018 . 2 . . 292 . A 43 ASP HB2 . 30684 1
193 . 1 . 1 43 43 ASP HB3 H 1 2.631 0.016 . 2 . . 293 . A 43 ASP HB3 . 30684 1
194 . 1 . 1 43 43 ASP C C 13 176.777 . . 1 . . 488 . A 43 ASP C . 30684 1
195 . 1 . 1 43 43 ASP CA C 13 52.882 . . 1 . . 102 . A 43 ASP CA . 30684 1
196 . 1 . 1 43 43 ASP CB C 13 40.449 0.0 . 1 . . 123 . A 43 ASP CB . 30684 1
197 . 1 . 1 43 43 ASP N N 15 122.965 . . 1 . . 18 . A 43 ASP N . 30684 1
198 . 1 . 1 44 44 THR H H 1 8.078 0.009 . 1 . . 19 . A 44 THR H . 30684 1
199 . 1 . 1 44 44 THR HA H 1 4.409 . . 1 . . 298 . A 44 THR HA . 30684 1
200 . 1 . 1 44 44 THR HB H 1 4.225 0.007 . 1 . . 299 . A 44 THR HB . 30684 1
201 . 1 . 1 44 44 THR HG21 H 1 1.224 0.019 . 1 . . 297 . A 44 THR HG21 . 30684 1
202 . 1 . 1 44 44 THR HG22 H 1 1.224 0.019 . 1 . . 297 . A 44 THR HG22 . 30684 1
203 . 1 . 1 44 44 THR HG23 H 1 1.224 0.019 . 1 . . 297 . A 44 THR HG23 . 30684 1
204 . 1 . 1 44 44 THR C C 13 175.344 . . 1 . . 489 . A 44 THR C . 30684 1
205 . 1 . 1 44 44 THR CA C 13 62.953 . . 1 . . 124 . A 44 THR CA . 30684 1
206 . 1 . 1 44 44 THR CB C 13 68.920 . . 1 . . 125 . A 44 THR CB . 30684 1
207 . 1 . 1 44 44 THR CG2 C 13 22.125 . . 1 . . 449 . A 44 THR CG2 . 30684 1
208 . 1 . 1 44 44 THR N N 15 113.609 . . 1 . . 20 . A 44 THR N . 30684 1
209 . 1 . 1 45 45 ASP H H 1 8.553 0.011 . 1 . . 194 . A 45 ASP H . 30684 1
210 . 1 . 1 45 45 ASP HA H 1 4.893 . . 1 . . 294 . A 45 ASP HA . 30684 1
211 . 1 . 1 45 45 ASP HB2 H 1 2.783 0.001 . 2 . . 295 . A 45 ASP HB2 . 30684 1
212 . 1 . 1 45 45 ASP HB3 H 1 2.700 . . 2 . . 296 . A 45 ASP HB3 . 30684 1
213 . 1 . 1 45 45 ASP C C 13 176.777 . . 1 . . 490 . A 45 ASP C . 30684 1
214 . 1 . 1 45 45 ASP CA C 13 55.285 . . 1 . . 128 . A 45 ASP CA . 30684 1
215 . 1 . 1 45 45 ASP CB C 13 41.950 . . 1 . . 129 . A 45 ASP CB . 30684 1
216 . 1 . 1 45 45 ASP N N 15 120.442 . . 1 . . 195 . A 45 ASP N . 30684 1
217 . 1 . 1 46 46 SER H H 1 8.020 0.006 . 1 . . 23 . A 46 SER H . 30684 1
218 . 1 . 1 46 46 SER HA H 1 4.792 . . 1 . . 300 . A 46 SER HA . 30684 1
219 . 1 . 1 46 46 SER HB2 H 1 4.056 0.012 . 2 . . 301 . A 46 SER HB2 . 30684 1
220 . 1 . 1 46 46 SER HB3 H 1 3.800 0.011 . 2 . . 302 . A 46 SER HB3 . 30684 1
221 . 1 . 1 46 46 SER C C 13 174.169 . . 1 . . 491 . A 46 SER C . 30684 1
222 . 1 . 1 46 46 SER CA C 13 59.458 . . 1 . . 127 . A 46 SER CA . 30684 1
223 . 1 . 1 46 46 SER CB C 13 63.861 0.034 . 1 . . 126 . A 46 SER CB . 30684 1
224 . 1 . 1 46 46 SER N N 15 117.063 0.0 . 1 . . 24 . A 46 SER N . 30684 1
225 . 1 . 1 47 47 LEU H H 1 8.629 0.011 . 1 . . 73 . A 47 LEU H . 30684 1
226 . 1 . 1 47 47 LEU HA H 1 4.268 0.001 . 1 . . 303 . A 47 LEU HA . 30684 1
227 . 1 . 1 47 47 LEU HB2 H 1 1.140 0.005 . 2 . . 616 . A 47 LEU HB2 . 30684 1
228 . 1 . 1 47 47 LEU HB3 H 1 1.447 0.023 . 2 . . 617 . A 47 LEU HB3 . 30684 1
229 . 1 . 1 47 47 LEU HD11 H 1 0.802 0.016 . 2 . . 608 . A 47 LEU HD11 . 30684 1
230 . 1 . 1 47 47 LEU HD12 H 1 0.802 0.016 . 2 . . 608 . A 47 LEU HD12 . 30684 1
231 . 1 . 1 47 47 LEU HD13 H 1 0.802 0.016 . 2 . . 608 . A 47 LEU HD13 . 30684 1
232 . 1 . 1 47 47 LEU HD21 H 1 0.631 0.013 . 2 . . 610 . A 47 LEU HD21 . 30684 1
233 . 1 . 1 47 47 LEU HD22 H 1 0.631 0.013 . 2 . . 610 . A 47 LEU HD22 . 30684 1
234 . 1 . 1 47 47 LEU HD23 H 1 0.631 0.013 . 2 . . 610 . A 47 LEU HD23 . 30684 1
235 . 1 . 1 47 47 LEU C C 13 176.490 . . 1 . . 492 . A 47 LEU C . 30684 1
236 . 1 . 1 47 47 LEU CA C 13 54.684 . . 1 . . 130 . A 47 LEU CA . 30684 1
237 . 1 . 1 47 47 LEU CB C 13 44.585 0.101 . 1 . . 131 . A 47 LEU CB . 30684 1
238 . 1 . 1 47 47 LEU CD1 C 13 21.782 0.0 . 2 . . 609 . A 47 LEU CD1 . 30684 1
239 . 1 . 1 47 47 LEU CD2 C 13 25.567 . . 2 . . 611 . A 47 LEU CD2 . 30684 1
240 . 1 . 1 47 47 LEU N N 15 122.313 0.0 . 1 . . 74 . A 47 LEU N . 30684 1
241 . 1 . 1 48 48 LYS H H 1 8.296 0.004 . 1 . . 69 . A 48 LYS H . 30684 1
242 . 1 . 1 48 48 LYS HA H 1 4.593 0.002 . 1 . . 304 . A 48 LYS HA . 30684 1
243 . 1 . 1 48 48 LYS HB2 H 1 1.526 0.025 . 2 . . 340 . A 48 LYS HB2 . 30684 1
244 . 1 . 1 48 48 LYS HB3 H 1 1.171 0.018 . 2 . . 341 . A 48 LYS HB3 . 30684 1
245 . 1 . 1 48 48 LYS HG2 H 1 1.699 . . 2 . . 339 . A 48 LYS HG2 . 30684 1
246 . 1 . 1 48 48 LYS HG3 H 1 1.683 . . 2 . . 342 . A 48 LYS HG3 . 30684 1
247 . 1 . 1 48 48 LYS HD2 H 1 1.850 . . 2 . . 337 . A 48 LYS HD2 . 30684 1
248 . 1 . 1 48 48 LYS HD3 H 1 1.845 . . 2 . . 338 . A 48 LYS HD3 . 30684 1
249 . 1 . 1 48 48 LYS HE2 H 1 2.921 . . 1 . . 305 . A 48 LYS HE2 . 30684 1
250 . 1 . 1 48 48 LYS HE3 H 1 2.921 . . 1 . . 336 . A 48 LYS HE3 . 30684 1
251 . 1 . 1 48 48 LYS C C 13 175.946 . . 1 . . 493 . A 48 LYS C . 30684 1
252 . 1 . 1 48 48 LYS CA C 13 56.546 . . 1 . . 132 . A 48 LYS CA . 30684 1
253 . 1 . 1 48 48 LYS CB C 13 32.460 . . 1 . . 133 . A 48 LYS CB . 30684 1
254 . 1 . 1 48 48 LYS CG C 13 25.622 . . 1 . . 450 . A 48 LYS CG . 30684 1
255 . 1 . 1 48 48 LYS CD C 13 29.627 . . 1 . . 448 . A 48 LYS CD . 30684 1
256 . 1 . 1 48 48 LYS N N 15 123.206 0.0 . 1 . . 70 . A 48 LYS N . 30684 1
257 . 1 . 1 49 49 ILE H H 1 8.521 0.025 . 1 . . 83 . A 49 ILE H . 30684 1
258 . 1 . 1 49 49 ILE HA H 1 4.853 0.004 . 1 . . 306 . A 49 ILE HA . 30684 1
259 . 1 . 1 49 49 ILE HB H 1 1.926 0.013 . 1 . . 307 . A 49 ILE HB . 30684 1
260 . 1 . 1 49 49 ILE HG12 H 1 1.634 0.014 . 2 . . 308 . A 49 ILE HG12 . 30684 1
261 . 1 . 1 49 49 ILE HG13 H 1 1.383 0.018 . 2 . . 662 . A 49 ILE HG13 . 30684 1
262 . 1 . 1 49 49 ILE HG21 H 1 0.619 0.01 . 1 . . 584 . A 49 ILE HG21 . 30684 1
263 . 1 . 1 49 49 ILE HG22 H 1 0.619 0.01 . 1 . . 584 . A 49 ILE HG22 . 30684 1
264 . 1 . 1 49 49 ILE HG23 H 1 0.619 0.01 . 1 . . 584 . A 49 ILE HG23 . 30684 1
265 . 1 . 1 49 49 ILE HD11 H 1 0.874 0.003 . 1 . . 649 . A 49 ILE HD11 . 30684 1
266 . 1 . 1 49 49 ILE HD12 H 1 0.874 0.003 . 1 . . 649 . A 49 ILE HD12 . 30684 1
267 . 1 . 1 49 49 ILE HD13 H 1 0.874 0.003 . 1 . . 649 . A 49 ILE HD13 . 30684 1
268 . 1 . 1 49 49 ILE C C 13 174.169 . . 1 . . 494 . A 49 ILE C . 30684 1
269 . 1 . 1 49 49 ILE CA C 13 59.610 . . 1 . . 134 . A 49 ILE CA . 30684 1
270 . 1 . 1 49 49 ILE CB C 13 41.169 . . 1 . . 135 . A 49 ILE CB . 30684 1
271 . 1 . 1 49 49 ILE CG1 C 13 25.609 0.016 . 1 . . 451 . A 49 ILE CG1 . 30684 1
272 . 1 . 1 49 49 ILE CG2 C 13 18.143 0.002 . 1 . . 585 . A 49 ILE CG2 . 30684 1
273 . 1 . 1 49 49 ILE CD1 C 13 11.020 0.023 . 1 . . 650 . A 49 ILE CD1 . 30684 1
274 . 1 . 1 49 49 ILE N N 15 120.025 . . 1 . . 84 . A 49 ILE N . 30684 1
275 . 1 . 1 50 50 LYS H H 1 9.193 0.01 . 1 . . 49 . A 50 LYS H . 30684 1
276 . 1 . 1 50 50 LYS HA H 1 4.850 0.005 . 1 . . 309 . A 50 LYS HA . 30684 1
277 . 1 . 1 50 50 LYS HB2 H 1 1.196 . . 2 . . 313 . A 50 LYS HB2 . 30684 1
278 . 1 . 1 50 50 LYS HB3 H 1 1.208 . . 2 . . 317 . A 50 LYS HB3 . 30684 1
279 . 1 . 1 50 50 LYS HG2 H 1 1.444 . . 2 . . 312 . A 50 LYS HG2 . 30684 1
280 . 1 . 1 50 50 LYS HG3 H 1 1.437 . . 2 . . 316 . A 50 LYS HG3 . 30684 1
281 . 1 . 1 50 50 LYS HD2 H 1 1.594 . . 1 . . 311 . A 50 LYS HD2 . 30684 1
282 . 1 . 1 50 50 LYS HD3 H 1 1.594 . . 1 . . 315 . A 50 LYS HD3 . 30684 1
283 . 1 . 1 50 50 LYS HE2 H 1 2.921 . . 1 . . 310 . A 50 LYS HE2 . 30684 1
284 . 1 . 1 50 50 LYS HE3 H 1 2.921 . . 1 . . 314 . A 50 LYS HE3 . 30684 1
285 . 1 . 1 50 50 LYS C C 13 174.943 . . 1 . . 495 . A 50 LYS C . 30684 1
286 . 1 . 1 50 50 LYS CA C 13 53.363 . . 1 . . 137 . A 50 LYS CA . 30684 1
287 . 1 . 1 50 50 LYS CB C 13 35.944 . . 1 . . 136 . A 50 LYS CB . 30684 1
288 . 1 . 1 50 50 LYS CG C 13 23.737 . . 1 . . 453 . A 50 LYS CG . 30684 1
289 . 1 . 1 50 50 LYS CD C 13 28.803 . . 1 . . 452 . A 50 LYS CD . 30684 1
290 . 1 . 1 50 50 LYS CE C 13 42.114 . . 1 . . 454 . A 50 LYS CE . 30684 1
291 . 1 . 1 50 50 LYS N N 15 125.583 0.0 . 1 . . 50 . A 50 LYS N . 30684 1
292 . 1 . 1 51 51 LYS H H 1 8.621 0.011 . 1 . . 77 . A 51 LYS H . 30684 1
293 . 1 . 1 51 51 LYS HA H 1 3.396 0.006 . 1 . . 318 . A 51 LYS HA . 30684 1
294 . 1 . 1 51 51 LYS HB2 H 1 1.249 0.004 . 2 . . 325 . A 51 LYS HB2 . 30684 1
295 . 1 . 1 51 51 LYS HB3 H 1 1.223 . . 2 . . 326 . A 51 LYS HB3 . 30684 1
296 . 1 . 1 51 51 LYS HG2 H 1 1.443 0.003 . 2 . . 323 . A 51 LYS HG2 . 30684 1
297 . 1 . 1 51 51 LYS HG3 H 1 1.457 . . 2 . . 324 . A 51 LYS HG3 . 30684 1
298 . 1 . 1 51 51 LYS HD2 H 1 1.728 0.008 . 2 . . 321 . A 51 LYS HD2 . 30684 1
299 . 1 . 1 51 51 LYS HD3 H 1 1.657 . . 2 . . 322 . A 51 LYS HD3 . 30684 1
300 . 1 . 1 51 51 LYS HE2 H 1 3.058 . . 2 . . 319 . A 51 LYS HE2 . 30684 1
301 . 1 . 1 51 51 LYS HE3 H 1 3.053 . . 2 . . 320 . A 51 LYS HE3 . 30684 1
302 . 1 . 1 51 51 LYS C C 13 177.321 . . 1 . . 496 . A 51 LYS C . 30684 1
303 . 1 . 1 51 51 LYS CA C 13 58.709 . . 1 . . 139 . A 51 LYS CA . 30684 1
304 . 1 . 1 51 51 LYS CB C 13 32.400 . . 1 . . 138 . A 51 LYS CB . 30684 1
305 . 1 . 1 51 51 LYS CG C 13 24.562 . . 1 . . 456 . A 51 LYS CG . 30684 1
306 . 1 . 1 51 51 LYS CD C 13 29.627 . . 1 . . 455 . A 51 LYS CD . 30684 1
307 . 1 . 1 51 51 LYS CE C 13 41.996 . . 1 . . 457 . A 51 LYS CE . 30684 1
308 . 1 . 1 51 51 LYS N N 15 121.124 . . 1 . . 78 . A 51 LYS N . 30684 1
309 . 1 . 1 52 52 GLY H H 1 8.961 0.015 . 1 . . 29 . A 52 GLY H . 30684 1
310 . 1 . 1 52 52 GLY HA2 H 1 4.511 0.003 . 2 . . 327 . A 52 GLY HA2 . 30684 1
311 . 1 . 1 52 52 GLY HA3 H 1 3.410 0.016 . 2 . . 328 . A 52 GLY HA3 . 30684 1
312 . 1 . 1 52 52 GLY C C 13 174.628 . . 1 . . 497 . A 52 GLY C . 30684 1
313 . 1 . 1 52 52 GLY CA C 13 44.653 . . 1 . . 140 . A 52 GLY CA . 30684 1
314 . 1 . 1 52 52 GLY N N 15 114.764 0.0 . 1 . . 30 . A 52 GLY N . 30684 1
315 . 1 . 1 53 53 ASP H H 1 8.501 0.011 . 1 . . 75 . A 53 ASP H . 30684 1
316 . 1 . 1 53 53 ASP HA H 1 4.416 0.003 . 1 . . 329 . A 53 ASP HA . 30684 1
317 . 1 . 1 53 53 ASP HB2 H 1 2.687 0.007 . 2 . . 330 . A 53 ASP HB2 . 30684 1
318 . 1 . 1 53 53 ASP HB3 H 1 2.369 0.013 . 2 . . 331 . A 53 ASP HB3 . 30684 1
319 . 1 . 1 53 53 ASP C C 13 174.972 . . 1 . . 498 . A 53 ASP C . 30684 1
320 . 1 . 1 53 53 ASP CA C 13 55.940 0.0 . 1 . . 142 . A 53 ASP CA . 30684 1
321 . 1 . 1 53 53 ASP CB C 13 42.070 0.0 . 1 . . 141 . A 53 ASP CB . 30684 1
322 . 1 . 1 53 53 ASP N N 15 122.841 0.0 . 1 . . 76 . A 53 ASP N . 30684 1
323 . 1 . 1 54 54 ILE H H 1 8.286 0.008 . 1 . . 87 . A 54 ILE H . 30684 1
324 . 1 . 1 54 54 ILE HA H 1 4.935 0.003 . 1 . . 332 . A 54 ILE HA . 30684 1
325 . 1 . 1 54 54 ILE HB H 1 1.779 0.017 . 1 . . 333 . A 54 ILE HB . 30684 1
326 . 1 . 1 54 54 ILE HG12 H 1 1.595 0.012 . 2 . . 334 . A 54 ILE HG12 . 30684 1
327 . 1 . 1 54 54 ILE HG13 H 1 1.160 0.019 . 2 . . 335 . A 54 ILE HG13 . 30684 1
328 . 1 . 1 54 54 ILE HG21 H 1 0.698 0.017 . 1 . . 588 . A 54 ILE HG21 . 30684 1
329 . 1 . 1 54 54 ILE HG22 H 1 0.698 0.017 . 1 . . 588 . A 54 ILE HG22 . 30684 1
330 . 1 . 1 54 54 ILE HG23 H 1 0.698 0.017 . 1 . . 588 . A 54 ILE HG23 . 30684 1
331 . 1 . 1 54 54 ILE HD11 H 1 0.352 0.002 . 1 . . 651 . A 54 ILE HD11 . 30684 1
332 . 1 . 1 54 54 ILE HD12 H 1 0.352 0.002 . 1 . . 651 . A 54 ILE HD12 . 30684 1
333 . 1 . 1 54 54 ILE HD13 H 1 0.352 0.002 . 1 . . 651 . A 54 ILE HD13 . 30684 1
334 . 1 . 1 54 54 ILE C C 13 174.828 . . 1 . . 499 . A 54 ILE C . 30684 1
335 . 1 . 1 54 54 ILE CA C 13 59.129 0.0 . 1 . . 144 . A 54 ILE CA . 30684 1
336 . 1 . 1 54 54 ILE CB C 13 38.137 . . 1 . . 143 . A 54 ILE CB . 30684 1
337 . 1 . 1 54 54 ILE CG1 C 13 26.800 . . 1 . . 458 . A 54 ILE CG1 . 30684 1
338 . 1 . 1 54 54 ILE CG2 C 13 17.520 0.0 . 1 . . 589 . A 54 ILE CG2 . 30684 1
339 . 1 . 1 54 54 ILE CD1 C 13 14.985 . . 1 . . 652 . A 54 ILE CD1 . 30684 1
340 . 1 . 1 54 54 ILE N N 15 120.609 0.0 . 1 . . 88 . A 54 ILE N . 30684 1
341 . 1 . 1 55 55 ILE H H 1 9.031 0.011 . 1 . . 214 . A 55 ILE H . 30684 1
342 . 1 . 1 55 55 ILE HA H 1 4.146 0.008 . 1 . . 343 . A 55 ILE HA . 30684 1
343 . 1 . 1 55 55 ILE HB H 1 0.869 0.014 . 1 . . 618 . A 55 ILE HB . 30684 1
344 . 1 . 1 55 55 ILE HG12 H 1 1.188 0.011 . 2 . . 620 . A 55 ILE HG12 . 30684 1
345 . 1 . 1 55 55 ILE HG13 H 1 0.402 0.015 . 2 . . 621 . A 55 ILE HG13 . 30684 1
346 . 1 . 1 55 55 ILE HG21 H 1 0.347 0.02 . 1 . . 344 . A 55 ILE HG21 . 30684 1
347 . 1 . 1 55 55 ILE HG22 H 1 0.347 0.02 . 1 . . 344 . A 55 ILE HG22 . 30684 1
348 . 1 . 1 55 55 ILE HG23 H 1 0.347 0.02 . 1 . . 344 . A 55 ILE HG23 . 30684 1
349 . 1 . 1 55 55 ILE HD11 H 1 -0.314 0.011 . 1 . . 345 . A 55 ILE HD11 . 30684 1
350 . 1 . 1 55 55 ILE HD12 H 1 -0.314 0.011 . 1 . . 345 . A 55 ILE HD12 . 30684 1
351 . 1 . 1 55 55 ILE HD13 H 1 -0.314 0.011 . 1 . . 345 . A 55 ILE HD13 . 30684 1
352 . 1 . 1 55 55 ILE C C 13 175.917 . . 1 . . 500 . A 55 ILE C . 30684 1
353 . 1 . 1 55 55 ILE CA C 13 59.760 0.0 . 1 . . 216 . A 55 ILE CA . 30684 1
354 . 1 . 1 55 55 ILE CB C 13 42.516 . . 1 . . 619 . A 55 ILE CB . 30684 1
355 . 1 . 1 55 55 ILE CG1 C 13 27.711 0.006 . 1 . . 459 . A 55 ILE CG1 . 30684 1
356 . 1 . 1 55 55 ILE CG2 C 13 17.447 0.029 . 1 . . 460 . A 55 ILE CG2 . 30684 1
357 . 1 . 1 55 55 ILE CD1 C 13 12.984 0.032 . 1 . . 579 . A 55 ILE CD1 . 30684 1
358 . 1 . 1 55 55 ILE N N 15 126.351 0.0 . 1 . . 215 . A 55 ILE N . 30684 1
359 . 1 . 1 56 56 ASP H H 1 8.070 0.015 . 1 . . 217 . A 56 ASP H . 30684 1
360 . 1 . 1 56 56 ASP HA H 1 4.874 . . 1 . . 346 . A 56 ASP HA . 30684 1
361 . 1 . 1 56 56 ASP HB2 H 1 1.747 0.015 . 2 . . 347 . A 56 ASP HB2 . 30684 1
362 . 1 . 1 56 56 ASP HB3 H 1 0.958 0.015 . 2 . . 565 . A 56 ASP HB3 . 30684 1
363 . 1 . 1 56 56 ASP C C 13 174.800 . . 1 . . 501 . A 56 ASP C . 30684 1
364 . 1 . 1 56 56 ASP CA C 13 54.877 . . 1 . . 202 . A 56 ASP CA . 30684 1
365 . 1 . 1 56 56 ASP CB C 13 41.750 . . 1 . . 209 . A 56 ASP CB . 30684 1
366 . 1 . 1 56 56 ASP N N 15 127.296 0.0 . 1 . . 218 . A 56 ASP N . 30684 1
367 . 1 . 1 57 57 ILE H H 1 8.900 0.02 . 1 . . 210 . A 57 ILE H . 30684 1
368 . 1 . 1 57 57 ILE HA H 1 3.843 0.022 . 1 . . 348 . A 57 ILE HA . 30684 1
369 . 1 . 1 57 57 ILE HB H 1 1.614 0.016 . 1 . . 349 . A 57 ILE HB . 30684 1
370 . 1 . 1 57 57 ILE HG21 H 1 0.727 0.013 . 1 . . 594 . A 57 ILE HG21 . 30684 1
371 . 1 . 1 57 57 ILE HG22 H 1 0.727 0.013 . 1 . . 594 . A 57 ILE HG22 . 30684 1
372 . 1 . 1 57 57 ILE HG23 H 1 0.727 0.013 . 1 . . 594 . A 57 ILE HG23 . 30684 1
373 . 1 . 1 57 57 ILE HD11 H 1 0.940 0.015 . 1 . . 580 . A 57 ILE HD11 . 30684 1
374 . 1 . 1 57 57 ILE HD12 H 1 0.940 0.015 . 1 . . 580 . A 57 ILE HD12 . 30684 1
375 . 1 . 1 57 57 ILE HD13 H 1 0.940 0.015 . 1 . . 580 . A 57 ILE HD13 . 30684 1
376 . 1 . 1 57 57 ILE C C 13 174.656 . . 1 . . 502 . A 57 ILE C . 30684 1
377 . 1 . 1 57 57 ILE CA C 13 64.202 . . 1 . . 213 . A 57 ILE CA . 30684 1
378 . 1 . 1 57 57 ILE CB C 13 38.509 . . 1 . . 212 . A 57 ILE CB . 30684 1
379 . 1 . 1 57 57 ILE CG1 C 13 28.331 . . 1 . . 461 . A 57 ILE CG1 . 30684 1
380 . 1 . 1 57 57 ILE CG2 C 13 19.274 0.0 . 1 . . 595 . A 57 ILE CG2 . 30684 1
381 . 1 . 1 57 57 ILE CD1 C 13 14.888 0.053 . 1 . . 581 . A 57 ILE CD1 . 30684 1
382 . 1 . 1 57 57 ILE N N 15 125.434 0.188 . 1 . . 211 . A 57 ILE N . 30684 1
383 . 1 . 1 58 58 ILE H H 1 9.440 0.012 . 1 . . 207 . A 58 ILE H . 30684 1
384 . 1 . 1 58 58 ILE HA H 1 4.244 0.008 . 1 . . 350 . A 58 ILE HA . 30684 1
385 . 1 . 1 58 58 ILE HB H 1 1.789 0.024 . 1 . . 351 . A 58 ILE HB . 30684 1
386 . 1 . 1 58 58 ILE HG12 H 1 1.212 0.015 . 2 . . 352 . A 58 ILE HG12 . 30684 1
387 . 1 . 1 58 58 ILE HG13 H 1 0.951 . . 2 . . 353 . A 58 ILE HG13 . 30684 1
388 . 1 . 1 58 58 ILE HG21 H 1 0.671 0.017 . 1 . . 586 . A 58 ILE HG21 . 30684 1
389 . 1 . 1 58 58 ILE HG22 H 1 0.671 0.017 . 1 . . 586 . A 58 ILE HG22 . 30684 1
390 . 1 . 1 58 58 ILE HG23 H 1 0.671 0.017 . 1 . . 586 . A 58 ILE HG23 . 30684 1
391 . 1 . 1 58 58 ILE HD11 H 1 0.466 0.004 . 1 . . 631 . A 58 ILE HD11 . 30684 1
392 . 1 . 1 58 58 ILE HD12 H 1 0.466 0.004 . 1 . . 631 . A 58 ILE HD12 . 30684 1
393 . 1 . 1 58 58 ILE HD13 H 1 0.466 0.004 . 1 . . 631 . A 58 ILE HD13 . 30684 1
394 . 1 . 1 58 58 ILE C C 13 175.545 . . 1 . . 503 . A 58 ILE C . 30684 1
395 . 1 . 1 58 58 ILE CA C 13 63.995 . . 1 . . 148 . A 58 ILE CA . 30684 1
396 . 1 . 1 58 58 ILE CB C 13 40.050 . . 1 . . 147 . A 58 ILE CB . 30684 1
397 . 1 . 1 58 58 ILE CG1 C 13 29.627 . . 1 . . 462 . A 58 ILE CG1 . 30684 1
398 . 1 . 1 58 58 ILE CG2 C 13 16.480 0.034 . 1 . . 587 . A 58 ILE CG2 . 30684 1
399 . 1 . 1 58 58 ILE CD1 C 13 15.371 0.01 . 1 . . 632 . A 58 ILE CD1 . 30684 1
400 . 1 . 1 58 58 ILE N N 15 128.265 0.0 . 1 . . 208 . A 58 ILE N . 30684 1
401 . 1 . 1 59 59 CYS H H 1 7.907 0.01 . 1 . . 21 . A 59 CYS H . 30684 1
402 . 1 . 1 59 59 CYS HA H 1 3.861 0.01 . 1 . . 561 . A 59 CYS HA . 30684 1
403 . 1 . 1 59 59 CYS HB2 H 1 2.802 0.002 . 2 . . 629 . A 59 CYS HB2 . 30684 1
404 . 1 . 1 59 59 CYS HB3 H 1 2.783 0.006 . 2 . . 630 . A 59 CYS HB3 . 30684 1
405 . 1 . 1 59 59 CYS C C 13 171.963 . . 1 . . 504 . A 59 CYS C . 30684 1
406 . 1 . 1 59 59 CYS CA C 13 57.327 . . 1 . . 145 . A 59 CYS CA . 30684 1
407 . 1 . 1 59 59 CYS CB C 13 29.825 0.0 . 1 . . 146 . A 59 CYS CB . 30684 1
408 . 1 . 1 59 59 CYS N N 15 115.849 0.0 . 1 . . 22 . A 59 CYS N . 30684 1
409 . 1 . 1 60 60 LYS H H 1 8.384 0.006 . 1 . . 63 . A 60 LYS H . 30684 1
410 . 1 . 1 60 60 LYS HA H 1 3.307 0.014 . 1 . . 354 . A 60 LYS HA . 30684 1
411 . 1 . 1 60 60 LYS HB2 H 1 0.724 0.018 . 2 . . 627 . A 60 LYS HB2 . 30684 1
412 . 1 . 1 60 60 LYS HB3 H 1 0.878 0.007 . 2 . . 628 . A 60 LYS HB3 . 30684 1
413 . 1 . 1 60 60 LYS HG2 H 1 -0.678 0.01 . 2 . . 622 . A 60 LYS HG2 . 30684 1
414 . 1 . 1 60 60 LYS HG3 H 1 0.395 0.012 . 2 . . 624 . A 60 LYS HG3 . 30684 1
415 . 1 . 1 60 60 LYS HD2 H 1 1.056 0.013 . 2 . . 625 . A 60 LYS HD2 . 30684 1
416 . 1 . 1 60 60 LYS HD3 H 1 0.976 0.019 . 2 . . 626 . A 60 LYS HD3 . 30684 1
417 . 1 . 1 60 60 LYS HE2 H 1 2.473 0.006 . 2 . . 355 . A 60 LYS HE2 . 30684 1
418 . 1 . 1 60 60 LYS HE3 H 1 2.185 0.008 . 2 . . 356 . A 60 LYS HE3 . 30684 1
419 . 1 . 1 60 60 LYS C C 13 175.315 . . 1 . . 505 . A 60 LYS C . 30684 1
420 . 1 . 1 60 60 LYS CA C 13 54.084 . . 1 . . 150 . A 60 LYS CA . 30684 1
421 . 1 . 1 60 60 LYS CB C 13 33.270 . . 1 . . 149 . A 60 LYS CB . 30684 1
422 . 1 . 1 60 60 LYS CG C 13 23.979 0.0 . 1 . . 623 . A 60 LYS CG . 30684 1
423 . 1 . 1 60 60 LYS CD C 13 29.590 0.0 . 1 . . 463 . A 60 LYS CD . 30684 1
424 . 1 . 1 60 60 LYS CE C 13 41.879 0.0 . 1 . . 464 . A 60 LYS CE . 30684 1
425 . 1 . 1 60 60 LYS N N 15 124.964 0.0 . 1 . . 64 . A 60 LYS N . 30684 1
426 . 1 . 1 61 61 THR H H 1 6.944 0.01 . 1 . . 9 . A 61 THR H . 30684 1
427 . 1 . 1 61 61 THR HA H 1 3.305 . . 1 . . 566 . A 61 THR HA . 30684 1
428 . 1 . 1 61 61 THR HB H 1 3.305 . . 1 . . 567 . A 61 THR HB . 30684 1
429 . 1 . 1 61 61 THR HG21 H 1 1.386 . . 1 . . 597 . A 61 THR HG21 . 30684 1
430 . 1 . 1 61 61 THR HG22 H 1 1.386 . . 1 . . 597 . A 61 THR HG22 . 30684 1
431 . 1 . 1 61 61 THR HG23 H 1 1.386 . . 1 . . 597 . A 61 THR HG23 . 30684 1
432 . 1 . 1 61 61 THR CA C 13 59.670 . . 1 . . 151 . A 61 THR CA . 30684 1
433 . 1 . 1 61 61 THR CB C 13 69.641 . . 1 . . 152 . A 61 THR CB . 30684 1
434 . 1 . 1 61 61 THR CG2 C 13 19.256 . . 1 . . 598 . A 61 THR CG2 . 30684 1
435 . 1 . 1 61 61 THR N N 15 114.687 0.0 . 1 . . 10 . A 61 THR N . 30684 1
436 . 1 . 1 63 63 MET HA H 1 4.501 . . 1 . . 357 . A 63 MET HA . 30684 1
437 . 1 . 1 63 63 MET HB2 H 1 2.577 . . 2 . . 358 . A 63 MET HB2 . 30684 1
438 . 1 . 1 63 63 MET HB3 H 1 2.552 . . 2 . . 359 . A 63 MET HB3 . 30684 1
439 . 1 . 1 63 63 MET HE1 H 1 2.089 . . 1 . . 575 . A 63 MET HE1 . 30684 1
440 . 1 . 1 63 63 MET HE2 H 1 2.089 . . 1 . . 575 . A 63 MET HE2 . 30684 1
441 . 1 . 1 63 63 MET HE3 H 1 2.089 . . 1 . . 575 . A 63 MET HE3 . 30684 1
442 . 1 . 1 63 63 MET C C 13 176.548 . . 1 . . 531 . A 63 MET C . 30684 1
443 . 1 . 1 63 63 MET CA C 13 55.652 0.007 . 1 . . 205 . A 63 MET CA . 30684 1
444 . 1 . 1 63 63 MET CB C 13 31.811 . . 1 . . 206 . A 63 MET CB . 30684 1
445 . 1 . 1 63 63 MET CG C 13 31.512 . . 1 . . 465 . A 63 MET CG . 30684 1
446 . 1 . 1 63 63 MET CE C 13 17.015 . . 1 . . 576 . A 63 MET CE . 30684 1
447 . 1 . 1 64 64 GLY H H 1 7.829 0.004 . 1 . . 203 . A 64 GLY H . 30684 1
448 . 1 . 1 64 64 GLY HA2 H 1 4.100 . . 2 . . 360 . A 64 GLY HA2 . 30684 1
449 . 1 . 1 64 64 GLY HA3 H 1 3.820 . . 2 . . 361 . A 64 GLY HA3 . 30684 1
450 . 1 . 1 64 64 GLY C C 13 173.137 . . 1 . . 506 . A 64 GLY C . 30684 1
451 . 1 . 1 64 64 GLY CA C 13 45.596 . . 1 . . 155 . A 64 GLY CA . 30684 1
452 . 1 . 1 64 64 GLY N N 15 107.110 0.083 . 1 . . 204 . A 64 GLY N . 30684 1
453 . 1 . 1 65 65 MET H H 1 7.668 0.006 . 1 . . 89 . A 65 MET H . 30684 1
454 . 1 . 1 65 65 MET HA H 1 4.581 0.011 . 1 . . 362 . A 65 MET HA . 30684 1
455 . 1 . 1 65 65 MET HB2 H 1 2.402 0.023 . 2 . . 363 . A 65 MET HB2 . 30684 1
456 . 1 . 1 65 65 MET HB3 H 1 2.159 0.006 . 2 . . 677 . A 65 MET HB3 . 30684 1
457 . 1 . 1 65 65 MET HG2 H 1 1.831 0.007 . 2 . . 364 . A 65 MET HG2 . 30684 1
458 . 1 . 1 65 65 MET HG3 H 1 1.793 . . 2 . . 365 . A 65 MET HG3 . 30684 1
459 . 1 . 1 65 65 MET HE1 H 1 2.310 0.003 . 1 . . 573 . A 65 MET HE1 . 30684 1
460 . 1 . 1 65 65 MET HE2 H 1 2.310 0.003 . 1 . . 573 . A 65 MET HE2 . 30684 1
461 . 1 . 1 65 65 MET HE3 H 1 2.310 0.003 . 1 . . 573 . A 65 MET HE3 . 30684 1
462 . 1 . 1 65 65 MET C C 13 175.602 . . 1 . . 507 . A 65 MET C . 30684 1
463 . 1 . 1 65 65 MET CA C 13 54.684 . . 1 . . 153 . A 65 MET CA . 30684 1
464 . 1 . 1 65 65 MET CB C 13 32.820 . . 1 . . 154 . A 65 MET CB . 30684 1
465 . 1 . 1 65 65 MET CE C 13 18.013 . . 1 . . 574 . A 65 MET CE . 30684 1
466 . 1 . 1 65 65 MET N N 15 118.807 . . 1 . . 90 . A 65 MET N . 30684 1
467 . 1 . 1 66 66 TRP H H 1 8.610 0.012 . 1 . . 57 . A 66 TRP H . 30684 1
468 . 1 . 1 66 66 TRP HA H 1 5.024 0.01 . 1 . . 568 . A 66 TRP HA . 30684 1
469 . 1 . 1 66 66 TRP HB2 H 1 2.789 0.017 . 2 . . 366 . A 66 TRP HB2 . 30684 1
470 . 1 . 1 66 66 TRP HB3 H 1 1.783 0.016 . 2 . . 367 . A 66 TRP HB3 . 30684 1
471 . 1 . 1 66 66 TRP HD1 H 1 7.017 0.02 . 1 . . 534 . A 66 TRP HD1 . 30684 1
472 . 1 . 1 66 66 TRP HE1 H 1 9.863 0.009 . 1 . . 53 . A 66 TRP HE1 . 30684 1
473 . 1 . 1 66 66 TRP HE3 H 1 7.454 0.013 . 1 . . 538 . A 66 TRP HE3 . 30684 1
474 . 1 . 1 66 66 TRP HZ2 H 1 7.156 0.017 . 1 . . 532 . A 66 TRP HZ2 . 30684 1
475 . 1 . 1 66 66 TRP HZ3 H 1 6.893 0.018 . 1 . . 540 . A 66 TRP HZ3 . 30684 1
476 . 1 . 1 66 66 TRP HH2 H 1 7.170 0.016 . 1 . . 536 . A 66 TRP HH2 . 30684 1
477 . 1 . 1 66 66 TRP C C 13 174.370 . . 1 . . 508 . A 66 TRP C . 30684 1
478 . 1 . 1 66 66 TRP CA C 13 54.744 . . 1 . . 156 . A 66 TRP CA . 30684 1
479 . 1 . 1 66 66 TRP CB C 13 31.461 0.0 . 1 . . 157 . A 66 TRP CB . 30684 1
480 . 1 . 1 66 66 TRP CD1 C 13 123.140 0.0 . 1 . . 535 . A 66 TRP CD1 . 30684 1
481 . 1 . 1 66 66 TRP CE3 C 13 120.324 0.0 . 1 . . 539 . A 66 TRP CE3 . 30684 1
482 . 1 . 1 66 66 TRP CZ2 C 13 115.415 . . 1 . . 533 . A 66 TRP CZ2 . 30684 1
483 . 1 . 1 66 66 TRP CZ3 C 13 121.344 . . 1 . . 541 . A 66 TRP CZ3 . 30684 1
484 . 1 . 1 66 66 TRP CH2 C 13 125.195 0.0 . 1 . . 537 . A 66 TRP CH2 . 30684 1
485 . 1 . 1 66 66 TRP N N 15 127.893 0.0 . 1 . . 58 . A 66 TRP N . 30684 1
486 . 1 . 1 66 66 TRP NE1 N 15 127.722 0.0 . 1 . . 54 . A 66 TRP NE1 . 30684 1
487 . 1 . 1 67 67 THR H H 1 8.630 0.009 . 1 . . 25 . A 67 THR H . 30684 1
488 . 1 . 1 67 67 THR HA H 1 5.374 0.009 . 1 . . 368 . A 67 THR HA . 30684 1
489 . 1 . 1 67 67 THR HB H 1 3.871 0.004 . 1 . . 369 . A 67 THR HB . 30684 1
490 . 1 . 1 67 67 THR HG21 H 1 1.152 0.01 . 1 . . 601 . A 67 THR HG21 . 30684 1
491 . 1 . 1 67 67 THR HG22 H 1 1.152 0.01 . 1 . . 601 . A 67 THR HG22 . 30684 1
492 . 1 . 1 67 67 THR HG23 H 1 1.152 0.01 . 1 . . 601 . A 67 THR HG23 . 30684 1
493 . 1 . 1 67 67 THR C C 13 175.717 . . 1 . . 509 . A 67 THR C . 30684 1
494 . 1 . 1 67 67 THR CA C 13 61.292 0.0 . 1 . . 158 . A 67 THR CA . 30684 1
495 . 1 . 1 67 67 THR CB C 13 70.901 0.06 . 1 . . 159 . A 67 THR CB . 30684 1
496 . 1 . 1 67 67 THR CG2 C 13 22.161 0.007 . 1 . . 602 . A 67 THR CG2 . 30684 1
497 . 1 . 1 67 67 THR N N 15 114.302 0.0 . 1 . . 26 . A 67 THR N . 30684 1
498 . 1 . 1 68 68 GLY H H 1 9.687 0.017 . 1 . . 37 . A 68 GLY H . 30684 1
499 . 1 . 1 68 68 GLY HA2 H 1 4.778 . . 2 . . 370 . A 68 GLY HA2 . 30684 1
500 . 1 . 1 68 68 GLY HA3 H 1 3.913 0.008 . 2 . . 371 . A 68 GLY HA3 . 30684 1
501 . 1 . 1 68 68 GLY C C 13 168.209 . . 1 . . 510 . A 68 GLY C . 30684 1
502 . 1 . 1 68 68 GLY CA C 13 46.215 . . 1 . . 160 . A 68 GLY CA . 30684 1
503 . 1 . 1 68 68 GLY N N 15 113.917 0.0 . 1 . . 38 . A 68 GLY N . 30684 1
504 . 1 . 1 69 69 MET H H 1 9.362 0.007 . 1 . . 41 . A 69 MET H . 30684 1
505 . 1 . 1 69 69 MET HA H 1 5.580 0.015 . 1 . . 372 . A 69 MET HA . 30684 1
506 . 1 . 1 69 69 MET HB2 H 1 2.472 0.014 . 2 . . 373 . A 69 MET HB2 . 30684 1
507 . 1 . 1 69 69 MET HB3 H 1 2.241 0.026 . 2 . . 374 . A 69 MET HB3 . 30684 1
508 . 1 . 1 69 69 MET HG2 H 1 1.779 . . 2 . . 375 . A 69 MET HG2 . 30684 1
509 . 1 . 1 69 69 MET HG3 H 1 1.786 . . 2 . . 376 . A 69 MET HG3 . 30684 1
510 . 1 . 1 69 69 MET HE1 H 1 1.937 . . 1 . . 577 . A 69 MET HE1 . 30684 1
511 . 1 . 1 69 69 MET HE2 H 1 1.937 . . 1 . . 577 . A 69 MET HE2 . 30684 1
512 . 1 . 1 69 69 MET HE3 H 1 1.937 . . 1 . . 577 . A 69 MET HE3 . 30684 1
513 . 1 . 1 69 69 MET C C 13 174.083 . . 1 . . 512 . A 69 MET C . 30684 1
514 . 1 . 1 69 69 MET CA C 13 53.963 0.0 . 1 . . 162 . A 69 MET CA . 30684 1
515 . 1 . 1 69 69 MET CB C 13 37.505 . . 1 . . 161 . A 69 MET CB . 30684 1
516 . 1 . 1 69 69 MET CG C 13 31.630 . . 1 . . 466 . A 69 MET CG . 30684 1
517 . 1 . 1 69 69 MET CE C 13 17.015 . . 1 . . 578 . A 69 MET CE . 30684 1
518 . 1 . 1 69 69 MET N N 15 119.922 0.0 . 1 . . 42 . A 69 MET N . 30684 1
519 . 1 . 1 70 70 LEU H H 1 9.070 0.016 . 1 . . 55 . A 70 LEU H . 30684 1
520 . 1 . 1 70 70 LEU HA H 1 4.708 . . 1 . . 377 . A 70 LEU HA . 30684 1
521 . 1 . 1 70 70 LEU HB2 H 1 1.737 0.018 . 2 . . 378 . A 70 LEU HB2 . 30684 1
522 . 1 . 1 70 70 LEU HB3 H 1 1.166 0.018 . 2 . . 379 . A 70 LEU HB3 . 30684 1
523 . 1 . 1 70 70 LEU HD11 H 1 0.829 0.012 . 2 . . 380 . A 70 LEU HD11 . 30684 1
524 . 1 . 1 70 70 LEU HD12 H 1 0.829 0.012 . 2 . . 380 . A 70 LEU HD12 . 30684 1
525 . 1 . 1 70 70 LEU HD13 H 1 0.829 0.012 . 2 . . 380 . A 70 LEU HD13 . 30684 1
526 . 1 . 1 70 70 LEU HD21 H 1 0.875 0.017 . 2 . . 654 . A 70 LEU HD21 . 30684 1
527 . 1 . 1 70 70 LEU HD22 H 1 0.875 0.017 . 2 . . 654 . A 70 LEU HD22 . 30684 1
528 . 1 . 1 70 70 LEU HD23 H 1 0.875 0.017 . 2 . . 654 . A 70 LEU HD23 . 30684 1
529 . 1 . 1 70 70 LEU C C 13 176.032 . . 1 . . 530 . A 70 LEU C . 30684 1
530 . 1 . 1 70 70 LEU CA C 13 54.114 . . 1 . . 228 . A 70 LEU CA . 30684 1
531 . 1 . 1 70 70 LEU CB C 13 46.843 0.045 . 1 . . 163 . A 70 LEU CB . 30684 1
532 . 1 . 1 70 70 LEU CG C 13 27.153 . . 1 . . 467 . A 70 LEU CG . 30684 1
533 . 1 . 1 70 70 LEU CD1 C 13 23.744 0.071 . 2 . . 653 . A 70 LEU CD1 . 30684 1
534 . 1 . 1 70 70 LEU CD2 C 13 22.495 0.008 . 2 . . 655 . A 70 LEU CD2 . 30684 1
535 . 1 . 1 70 70 LEU N N 15 129.125 . . 1 . . 56 . A 70 LEU N . 30684 1
536 . 1 . 1 71 71 ASN H H 1 9.810 0.008 . 1 . . 226 . A 71 ASN H . 30684 1
537 . 1 . 1 71 71 ASN HA H 1 4.370 0.017 . 1 . . 381 . A 71 ASN HA . 30684 1
538 . 1 . 1 71 71 ASN HB2 H 1 2.972 0.014 . 2 . . 382 . A 71 ASN HB2 . 30684 1
539 . 1 . 1 71 71 ASN HB3 H 1 2.727 0.014 . 2 . . 383 . A 71 ASN HB3 . 30684 1
540 . 1 . 1 71 71 ASN HD21 H 1 7.662 0.004 . 1 . . 637 . A 71 ASN HD21 . 30684 1
541 . 1 . 1 71 71 ASN HD22 H 1 7.132 0.007 . 1 . . 639 . A 71 ASN HD22 . 30684 1
542 . 1 . 1 71 71 ASN C C 13 174.570 . . 1 . . 511 . A 71 ASN C . 30684 1
543 . 1 . 1 71 71 ASN CA C 13 54.662 . . 1 . . 225 . A 71 ASN CA . 30684 1
544 . 1 . 1 71 71 ASN CB C 13 37.489 . . 1 . . 229 . A 71 ASN CB . 30684 1
545 . 1 . 1 71 71 ASN N N 15 129.131 . . 1 . . 227 . A 71 ASN N . 30684 1
546 . 1 . 1 71 71 ASN ND2 N 15 114.009 0.014 . 1 . . 638 . A 71 ASN ND2 . 30684 1
547 . 1 . 1 72 72 ASN H H 1 8.971 0.007 . 1 . . 223 . A 72 ASN H . 30684 1
548 . 1 . 1 72 72 ASN HA H 1 4.417 0.011 . 1 . . 384 . A 72 ASN HA . 30684 1
549 . 1 . 1 72 72 ASN HB2 H 1 3.072 0.009 . 2 . . 643 . A 72 ASN HB2 . 30684 1
550 . 1 . 1 72 72 ASN HB3 H 1 3.038 0.01 . 2 . . 644 . A 72 ASN HB3 . 30684 1
551 . 1 . 1 72 72 ASN HD21 H 1 7.495 0.002 . 1 . . 640 . A 72 ASN HD21 . 30684 1
552 . 1 . 1 72 72 ASN HD22 H 1 6.878 0.002 . 1 . . 642 . A 72 ASN HD22 . 30684 1
553 . 1 . 1 72 72 ASN C C 13 173.481 . . 1 . . 513 . A 72 ASN C . 30684 1
554 . 1 . 1 72 72 ASN CA C 13 55.209 0.0 . 1 . . 221 . A 72 ASN CA . 30684 1
555 . 1 . 1 72 72 ASN CB C 13 38.035 . . 1 . . 222 . A 72 ASN CB . 30684 1
556 . 1 . 1 72 72 ASN N N 15 109.223 0.039 . 1 . . 224 . A 72 ASN N . 30684 1
557 . 1 . 1 72 72 ASN ND2 N 15 112.352 0.011 . 1 . . 641 . A 72 ASN ND2 . 30684 1
558 . 1 . 1 73 73 LYS H H 1 7.833 0.011 . 1 . . 219 . A 73 LYS H . 30684 1
559 . 1 . 1 73 73 LYS HA H 1 4.684 . . 1 . . 385 . A 73 LYS HA . 30684 1
560 . 1 . 1 73 73 LYS HB2 H 1 1.459 0.016 . 2 . . 392 . A 73 LYS HB2 . 30684 1
561 . 1 . 1 73 73 LYS HB3 H 1 1.411 0.02 . 2 . . 393 . A 73 LYS HB3 . 30684 1
562 . 1 . 1 73 73 LYS HG2 H 1 1.782 . . 2 . . 390 . A 73 LYS HG2 . 30684 1
563 . 1 . 1 73 73 LYS HG3 H 1 1.738 . . 2 . . 391 . A 73 LYS HG3 . 30684 1
564 . 1 . 1 73 73 LYS HD2 H 1 1.889 . . 1 . . 388 . A 73 LYS HD2 . 30684 1
565 . 1 . 1 73 73 LYS HD3 H 1 1.889 . . 1 . . 389 . A 73 LYS HD3 . 30684 1
566 . 1 . 1 73 73 LYS HE2 H 1 3.053 . . 1 . . 386 . A 73 LYS HE2 . 30684 1
567 . 1 . 1 73 73 LYS HE3 H 1 3.053 . . 1 . . 387 . A 73 LYS HE3 . 30684 1
568 . 1 . 1 73 73 LYS C C 13 174.427 . . 1 . . 514 . A 73 LYS C . 30684 1
569 . 1 . 1 73 73 LYS CA C 13 55.013 . . 1 . . 168 . A 73 LYS CA . 30684 1
570 . 1 . 1 73 73 LYS CB C 13 35.012 . . 1 . . 167 . A 73 LYS CB . 30684 1
571 . 1 . 1 73 73 LYS CG C 13 24.797 . . 1 . . 469 . A 73 LYS CG . 30684 1
572 . 1 . 1 73 73 LYS CD C 13 28.920 . . 1 . . 468 . A 73 LYS CD . 30684 1
573 . 1 . 1 73 73 LYS CE C 13 42.468 . . 1 . . 470 . A 73 LYS CE . 30684 1
574 . 1 . 1 73 73 LYS N N 15 120.920 0.0 . 1 . . 220 . A 73 LYS N . 30684 1
575 . 1 . 1 74 74 VAL H H 1 8.542 0.014 . 1 . . 67 . A 74 VAL H . 30684 1
576 . 1 . 1 74 74 VAL HA H 1 4.998 0.007 . 1 . . 394 . A 74 VAL HA . 30684 1
577 . 1 . 1 74 74 VAL HB H 1 1.861 0.011 . 1 . . 395 . A 74 VAL HB . 30684 1
578 . 1 . 1 74 74 VAL HG11 H 1 0.727 0.017 . 2 . . 607 . A 74 VAL HG11 . 30684 1
579 . 1 . 1 74 74 VAL HG12 H 1 0.727 0.017 . 2 . . 607 . A 74 VAL HG12 . 30684 1
580 . 1 . 1 74 74 VAL HG13 H 1 0.727 0.017 . 2 . . 607 . A 74 VAL HG13 . 30684 1
581 . 1 . 1 74 74 VAL HG21 H 1 0.694 0.004 . 2 . . 614 . A 74 VAL HG21 . 30684 1
582 . 1 . 1 74 74 VAL HG22 H 1 0.694 0.004 . 2 . . 614 . A 74 VAL HG22 . 30684 1
583 . 1 . 1 74 74 VAL HG23 H 1 0.694 0.004 . 2 . . 614 . A 74 VAL HG23 . 30684 1
584 . 1 . 1 74 74 VAL C C 13 176.748 . . 1 . . 515 . A 74 VAL C . 30684 1
585 . 1 . 1 74 74 VAL CA C 13 60.751 . . 1 . . 164 . A 74 VAL CA . 30684 1
586 . 1 . 1 74 74 VAL CB C 13 32.920 . . 1 . . 165 . A 74 VAL CB . 30684 1
587 . 1 . 1 74 74 VAL CG2 C 13 21.320 0.014 . 1 . . 615 . A 74 VAL CG2 . 30684 1
588 . 1 . 1 74 74 VAL N N 15 123.828 . . 1 . . 68 . A 74 VAL N . 30684 1
589 . 1 . 1 75 75 GLY H H 1 8.971 0.014 . 1 . . 39 . A 75 GLY H . 30684 1
590 . 1 . 1 75 75 GLY HA2 H 1 4.387 0.006 . 2 . . 396 . A 75 GLY HA2 . 30684 1
591 . 1 . 1 75 75 GLY HA3 H 1 3.977 0.008 . 2 . . 397 . A 75 GLY HA3 . 30684 1
592 . 1 . 1 75 75 GLY C C 13 171.561 . . 1 . . 516 . A 75 GLY C . 30684 1
593 . 1 . 1 75 75 GLY CA C 13 45.578 0.106 . 1 . . 166 . A 75 GLY CA . 30684 1
594 . 1 . 1 75 75 GLY N N 15 112.916 0.0 . 1 . . 40 . A 75 GLY N . 30684 1
595 . 1 . 1 76 76 ASN H H 1 8.895 0.013 . 1 . . 234 . A 76 ASN H . 30684 1
596 . 1 . 1 76 76 ASN HA H 1 6.156 0.01 . 1 . . 398 . A 76 ASN HA . 30684 1
597 . 1 . 1 76 76 ASN HB2 H 1 2.830 0.015 . 2 . . 236 . A 76 ASN HB2 . 30684 1
598 . 1 . 1 76 76 ASN HB3 H 1 2.699 0.023 . 2 . . 237 . A 76 ASN HB3 . 30684 1
599 . 1 . 1 76 76 ASN HD21 H 1 7.531 0.007 . 1 . . 230 . A 76 ASN HD21 . 30684 1
600 . 1 . 1 76 76 ASN HD22 H 1 6.953 0.004 . 1 . . 232 . A 76 ASN HD22 . 30684 1
601 . 1 . 1 76 76 ASN C C 13 176.691 . . 1 . . 517 . A 76 ASN C . 30684 1
602 . 1 . 1 76 76 ASN CA C 13 52.054 0.032 . 1 . . 673 . A 76 ASN CA . 30684 1
603 . 1 . 1 76 76 ASN CB C 13 41.015 0.04 . 1 . . 233 . A 76 ASN CB . 30684 1
604 . 1 . 1 76 76 ASN N N 15 116.497 0.0 . 1 . . 235 . A 76 ASN N . 30684 1
605 . 1 . 1 76 76 ASN ND2 N 15 112.165 0.01 . 1 . . 231 . A 76 ASN ND2 . 30684 1
606 . 1 . 1 77 77 PHE H H 1 9.134 0.012 . 1 . . 33 . A 77 PHE H . 30684 1
607 . 1 . 1 77 77 PHE HA H 1 5.078 0.007 . 1 . . 674 . A 77 PHE HA . 30684 1
608 . 1 . 1 77 77 PHE HB2 H 1 3.096 0.017 . 2 . . 399 . A 77 PHE HB2 . 30684 1
609 . 1 . 1 77 77 PHE HB3 H 1 2.734 0.01 . 2 . . 400 . A 77 PHE HB3 . 30684 1
610 . 1 . 1 77 77 PHE HD1 H 1 6.913 0.014 . 1 . . 550 . A 77 PHE HD1 . 30684 1
611 . 1 . 1 77 77 PHE HD2 H 1 6.913 0.014 . 1 . . 550 . A 77 PHE HD2 . 30684 1
612 . 1 . 1 77 77 PHE HE1 H 1 7.333 0.001 . 1 . . 569 . A 77 PHE HE1 . 30684 1
613 . 1 . 1 77 77 PHE HE2 H 1 7.333 0.001 . 1 . . 569 . A 77 PHE HE2 . 30684 1
614 . 1 . 1 77 77 PHE C C 13 171.676 . . 1 . . 518 . A 77 PHE C . 30684 1
615 . 1 . 1 77 77 PHE CA C 13 56.378 . . 1 . . 169 . A 77 PHE CA . 30684 1
616 . 1 . 1 77 77 PHE CB C 13 40.973 0.036 . 1 . . 170 . A 77 PHE CB . 30684 1
617 . 1 . 1 77 77 PHE CD1 C 13 130.370 0.0 . 1 . . 551 . A 77 PHE CD1 . 30684 1
618 . 1 . 1 77 77 PHE CD2 C 13 130.370 0.0 . 1 . . 551 . A 77 PHE CD2 . 30684 1
619 . 1 . 1 77 77 PHE N N 15 117.747 0.0 . 1 . . 34 . A 77 PHE N . 30684 1
620 . 1 . 1 78 78 LYS H H 1 8.569 0.014 . 1 . . 85 . A 78 LYS H . 30684 1
621 . 1 . 1 78 78 LYS HA H 1 4.527 0.005 . 1 . . 401 . A 78 LYS HA . 30684 1
622 . 1 . 1 78 78 LYS HB2 H 1 1.108 . . 2 . . 408 . A 78 LYS HB2 . 30684 1
623 . 1 . 1 78 78 LYS HB3 H 1 1.078 . . 2 . . 409 . A 78 LYS HB3 . 30684 1
624 . 1 . 1 78 78 LYS HG2 H 1 1.330 0.013 . 2 . . 406 . A 78 LYS HG2 . 30684 1
625 . 1 . 1 78 78 LYS HG3 H 1 1.285 . . 2 . . 407 . A 78 LYS HG3 . 30684 1
626 . 1 . 1 78 78 LYS HD2 H 1 1.373 . . 1 . . 404 . A 78 LYS HD2 . 30684 1
627 . 1 . 1 78 78 LYS HD3 H 1 1.373 . . 1 . . 405 . A 78 LYS HD3 . 30684 1
628 . 1 . 1 78 78 LYS HE2 H 1 2.759 . . 1 . . 402 . A 78 LYS HE2 . 30684 1
629 . 1 . 1 78 78 LYS HE3 H 1 2.759 . . 1 . . 403 . A 78 LYS HE3 . 30684 1
630 . 1 . 1 78 78 LYS C C 13 177.665 . . 1 . . 519 . A 78 LYS C . 30684 1
631 . 1 . 1 78 78 LYS CA C 13 55.616 0.073 . 1 . . 171 . A 78 LYS CA . 30684 1
632 . 1 . 1 78 78 LYS CB C 13 34.147 0.051 . 1 . . 172 . A 78 LYS CB . 30684 1
633 . 1 . 1 78 78 LYS CG C 13 25.858 . . 1 . . 472 . A 78 LYS CG . 30684 1
634 . 1 . 1 78 78 LYS CD C 13 29.392 . . 1 . . 471 . A 78 LYS CD . 30684 1
635 . 1 . 1 78 78 LYS CE C 13 42.232 . . 1 . . 473 . A 78 LYS CE . 30684 1
636 . 1 . 1 78 78 LYS N N 15 120.416 0.023 . 1 . . 86 . A 78 LYS N . 30684 1
637 . 1 . 1 79 79 PHE H H 1 7.589 0.009 . 1 . . 15 . A 79 PHE H . 30684 1
638 . 1 . 1 79 79 PHE HA H 1 3.546 0.014 . 1 . . 560 . A 79 PHE HA . 30684 1
639 . 1 . 1 79 79 PHE HB2 H 1 1.835 0.013 . 2 . . 410 . A 79 PHE HB2 . 30684 1
640 . 1 . 1 79 79 PHE HB3 H 1 1.144 0.02 . 2 . . 411 . A 79 PHE HB3 . 30684 1
641 . 1 . 1 79 79 PHE HD1 H 1 6.678 0.01 . 1 . . 552 . A 79 PHE HD1 . 30684 1
642 . 1 . 1 79 79 PHE HD2 H 1 6.678 0.01 . 1 . . 552 . A 79 PHE HD2 . 30684 1
643 . 1 . 1 79 79 PHE HE1 H 1 7.239 0.014 . 1 . . 676 . A 79 PHE HE1 . 30684 1
644 . 1 . 1 79 79 PHE HE2 H 1 7.239 0.014 . 1 . . 676 . A 79 PHE HE2 . 30684 1
645 . 1 . 1 79 79 PHE C C 13 176.032 . . 1 . . 520 . A 79 PHE C . 30684 1
646 . 1 . 1 79 79 PHE CA C 13 58.884 0.015 . 1 . . 174 . A 79 PHE CA . 30684 1
647 . 1 . 1 79 79 PHE CB C 13 36.511 0.016 . 1 . . 173 . A 79 PHE CB . 30684 1
648 . 1 . 1 79 79 PHE CD1 C 13 132.120 . . 1 . . 553 . A 79 PHE CD1 . 30684 1
649 . 1 . 1 79 79 PHE CD2 C 13 132.120 . . 1 . . 553 . A 79 PHE CD2 . 30684 1
650 . 1 . 1 79 79 PHE CE1 C 13 132.006 . . 1 . . 656 . A 79 PHE CE1 . 30684 1
651 . 1 . 1 79 79 PHE CE2 C 13 132.006 . . 1 . . 656 . A 79 PHE CE2 . 30684 1
652 . 1 . 1 79 79 PHE N N 15 121.502 . . 1 . . 16 . A 79 PHE N . 30684 1
653 . 1 . 1 80 80 ILE H H 1 6.103 0.012 . 1 . . 1 . A 80 ILE H . 30684 1
654 . 1 . 1 80 80 ILE HA H 1 3.836 0.009 . 1 . . 412 . A 80 ILE HA . 30684 1
655 . 1 . 1 80 80 ILE HB H 1 1.628 0.009 . 1 . . 636 . A 80 ILE HB . 30684 1
656 . 1 . 1 80 80 ILE HG12 H 1 0.174 0.013 . 2 . . 633 . A 80 ILE HG12 . 30684 1
657 . 1 . 1 80 80 ILE HG13 H 1 0.342 0.002 . 2 . . 635 . A 80 ILE HG13 . 30684 1
658 . 1 . 1 80 80 ILE HG21 H 1 0.400 0.015 . 1 . . 582 . A 80 ILE HG21 . 30684 1
659 . 1 . 1 80 80 ILE HG22 H 1 0.400 0.015 . 1 . . 582 . A 80 ILE HG22 . 30684 1
660 . 1 . 1 80 80 ILE HG23 H 1 0.400 0.015 . 1 . . 582 . A 80 ILE HG23 . 30684 1
661 . 1 . 1 80 80 ILE HD11 H 1 0.486 0.017 . 1 . . 645 . A 80 ILE HD11 . 30684 1
662 . 1 . 1 80 80 ILE HD12 H 1 0.486 0.017 . 1 . . 645 . A 80 ILE HD12 . 30684 1
663 . 1 . 1 80 80 ILE HD13 H 1 0.486 0.017 . 1 . . 645 . A 80 ILE HD13 . 30684 1
664 . 1 . 1 80 80 ILE C C 13 175.745 . . 1 . . 521 . A 80 ILE C . 30684 1
665 . 1 . 1 80 80 ILE CA C 13 62.553 0.0 . 1 . . 175 . A 80 ILE CA . 30684 1
666 . 1 . 1 80 80 ILE CB C 13 37.780 . . 1 . . 176 . A 80 ILE CB . 30684 1
667 . 1 . 1 80 80 ILE CG1 C 13 25.932 0.0 . 1 . . 634 . A 80 ILE CG1 . 30684 1
668 . 1 . 1 80 80 ILE CG2 C 13 17.683 0.0 . 1 . . 583 . A 80 ILE CG2 . 30684 1
669 . 1 . 1 80 80 ILE CD1 C 13 13.928 0.0 . 1 . . 646 . A 80 ILE CD1 . 30684 1
670 . 1 . 1 80 80 ILE N N 15 111.106 0.0 . 1 . . 2 . A 80 ILE N . 30684 1
671 . 1 . 1 81 81 TYR H H 1 6.857 0.009 . 1 . . 11 . A 81 TYR H . 30684 1
672 . 1 . 1 81 81 TYR HA H 1 4.420 0.011 . 1 . . 413 . A 81 TYR HA . 30684 1
673 . 1 . 1 81 81 TYR HB2 H 1 3.642 0.021 . 2 . . 414 . A 81 TYR HB2 . 30684 1
674 . 1 . 1 81 81 TYR HB3 H 1 2.464 0.012 . 2 . . 415 . A 81 TYR HB3 . 30684 1
675 . 1 . 1 81 81 TYR HD1 H 1 6.925 0.013 . 1 . . 546 . A 81 TYR HD1 . 30684 1
676 . 1 . 1 81 81 TYR HD2 H 1 6.925 0.013 . 1 . . 546 . A 81 TYR HD2 . 30684 1
677 . 1 . 1 81 81 TYR HE1 H 1 6.439 0.01 . 1 . . 542 . A 81 TYR HE1 . 30684 1
678 . 1 . 1 81 81 TYR HE2 H 1 6.439 0.01 . 1 . . 542 . A 81 TYR HE2 . 30684 1
679 . 1 . 1 81 81 TYR C C 13 174.456 . . 1 . . 522 . A 81 TYR C . 30684 1
680 . 1 . 1 81 81 TYR CA C 13 57.128 0.108 . 1 . . 177 . A 81 TYR CA . 30684 1
681 . 1 . 1 81 81 TYR CB C 13 39.257 0.0 . 1 . . 178 . A 81 TYR CB . 30684 1
682 . 1 . 1 81 81 TYR CD1 C 13 132.539 0.0 . 1 . . 547 . A 81 TYR CD1 . 30684 1
683 . 1 . 1 81 81 TYR CD2 C 13 132.539 0.0 . 1 . . 547 . A 81 TYR CD2 . 30684 1
684 . 1 . 1 81 81 TYR CE1 C 13 118.117 0.0 . 1 . . 543 . A 81 TYR CE1 . 30684 1
685 . 1 . 1 81 81 TYR CE2 C 13 118.117 0.0 . 1 . . 543 . A 81 TYR CE2 . 30684 1
686 . 1 . 1 81 81 TYR N N 15 117.074 0.0 . 1 . . 12 . A 81 TYR N . 30684 1
687 . 1 . 1 82 82 VAL H H 1 7.330 0.01 . 1 . . 3 . A 82 VAL H . 30684 1
688 . 1 . 1 82 82 VAL HA H 1 4.960 0.004 . 1 . . 416 . A 82 VAL HA . 30684 1
689 . 1 . 1 82 82 VAL HB H 1 1.811 0.014 . 1 . . 417 . A 82 VAL HB . 30684 1
690 . 1 . 1 82 82 VAL HG11 H 1 0.582 0.013 . 2 . . 418 . A 82 VAL HG11 . 30684 1
691 . 1 . 1 82 82 VAL HG12 H 1 0.582 0.013 . 2 . . 418 . A 82 VAL HG12 . 30684 1
692 . 1 . 1 82 82 VAL HG13 H 1 0.582 0.013 . 2 . . 418 . A 82 VAL HG13 . 30684 1
693 . 1 . 1 82 82 VAL HG21 H 1 0.793 0.02 . 2 . . 592 . A 82 VAL HG21 . 30684 1
694 . 1 . 1 82 82 VAL HG22 H 1 0.793 0.02 . 2 . . 592 . A 82 VAL HG22 . 30684 1
695 . 1 . 1 82 82 VAL HG23 H 1 0.793 0.02 . 2 . . 592 . A 82 VAL HG23 . 30684 1
696 . 1 . 1 82 82 VAL C C 13 173.453 . . 1 . . 527 . A 82 VAL C . 30684 1
697 . 1 . 1 82 82 VAL CA C 13 57.928 0.0 . 1 . . 179 . A 82 VAL CA . 30684 1
698 . 1 . 1 82 82 VAL CB C 13 34.922 . . 1 . . 180 . A 82 VAL CB . 30684 1
699 . 1 . 1 82 82 VAL CG1 C 13 20.956 . . 2 . . 474 . A 82 VAL CG1 . 30684 1
700 . 1 . 1 82 82 VAL CG2 C 13 18.635 0.0 . 2 . . 593 . A 82 VAL CG2 . 30684 1
701 . 1 . 1 82 82 VAL N N 15 108.526 0.0 . 1 . . 4 . A 82 VAL N . 30684 1
702 . 1 . 1 83 83 ASP H H 1 8.625 0.01 . 1 . . 27 . A 83 ASP H . 30684 1
703 . 1 . 1 83 83 ASP HA H 1 5.222 0.007 . 1 . . 419 . A 83 ASP HA . 30684 1
704 . 1 . 1 83 83 ASP HB2 H 1 2.657 0.012 . 2 . . 420 . A 83 ASP HB2 . 30684 1
705 . 1 . 1 83 83 ASP HB3 H 1 2.543 0.016 . 2 . . 421 . A 83 ASP HB3 . 30684 1
706 . 1 . 1 83 83 ASP C C 13 175.975 . . 1 . . 526 . A 83 ASP C . 30684 1
707 . 1 . 1 83 83 ASP CA C 13 53.303 . . 1 . . 122 . A 83 ASP CA . 30684 1
708 . 1 . 1 83 83 ASP CB C 13 43.854 0.046 . 1 . . 181 . A 83 ASP CB . 30684 1
709 . 1 . 1 83 83 ASP N N 15 116.843 0.0 . 1 . . 28 . A 83 ASP N . 30684 1
710 . 1 . 1 84 84 VAL H H 1 9.287 0.014 . 1 . . 47 . A 84 VAL H . 30684 1
711 . 1 . 1 84 84 VAL HA H 1 4.174 0.011 . 1 . . 422 . A 84 VAL HA . 30684 1
712 . 1 . 1 84 84 VAL HB H 1 2.181 0.016 . 1 . . 423 . A 84 VAL HB . 30684 1
713 . 1 . 1 84 84 VAL HG11 H 1 1.305 0.015 . 2 . . 424 . A 84 VAL HG11 . 30684 1
714 . 1 . 1 84 84 VAL HG12 H 1 1.305 0.015 . 2 . . 424 . A 84 VAL HG12 . 30684 1
715 . 1 . 1 84 84 VAL HG13 H 1 1.305 0.015 . 2 . . 424 . A 84 VAL HG13 . 30684 1
716 . 1 . 1 84 84 VAL HG21 H 1 1.106 0.025 . 2 . . 603 . A 84 VAL HG21 . 30684 1
717 . 1 . 1 84 84 VAL HG22 H 1 1.106 0.025 . 2 . . 603 . A 84 VAL HG22 . 30684 1
718 . 1 . 1 84 84 VAL HG23 H 1 1.106 0.025 . 2 . . 603 . A 84 VAL HG23 . 30684 1
719 . 1 . 1 84 84 VAL C C 13 176.720 . . 1 . . 525 . A 84 VAL C . 30684 1
720 . 1 . 1 84 84 VAL CA C 13 64.715 . . 1 . . 183 . A 84 VAL CA . 30684 1
721 . 1 . 1 84 84 VAL CB C 13 31.679 . . 1 . . 182 . A 84 VAL CB . 30684 1
722 . 1 . 1 84 84 VAL CG1 C 13 22.687 . . 2 . . 475 . A 84 VAL CG1 . 30684 1
723 . 1 . 1 84 84 VAL CG2 C 13 21.862 0.169 . 2 . . 604 . A 84 VAL CG2 . 30684 1
724 . 1 . 1 84 84 VAL N N 15 124.680 0.0 . 1 . . 48 . A 84 VAL N . 30684 1
725 . 1 . 1 85 85 ILE H H 1 8.694 0.009 . 1 . . 65 . A 85 ILE H . 30684 1
726 . 1 . 1 85 85 ILE HA H 1 4.453 0.007 . 1 . . 425 . A 85 ILE HA . 30684 1
727 . 1 . 1 85 85 ILE HB H 1 1.933 0.013 . 1 . . 426 . A 85 ILE HB . 30684 1
728 . 1 . 1 85 85 ILE HG12 H 1 1.409 0.016 . 2 . . 427 . A 85 ILE HG12 . 30684 1
729 . 1 . 1 85 85 ILE HG13 H 1 1.384 0.004 . 2 . . 428 . A 85 ILE HG13 . 30684 1
730 . 1 . 1 85 85 ILE HG21 H 1 0.899 0.023 . 1 . . 590 . A 85 ILE HG21 . 30684 1
731 . 1 . 1 85 85 ILE HG22 H 1 0.899 0.023 . 1 . . 590 . A 85 ILE HG22 . 30684 1
732 . 1 . 1 85 85 ILE HG23 H 1 0.899 0.023 . 1 . . 590 . A 85 ILE HG23 . 30684 1
733 . 1 . 1 85 85 ILE HD11 H 1 0.780 0.017 . 1 . . 647 . A 85 ILE HD11 . 30684 1
734 . 1 . 1 85 85 ILE HD12 H 1 0.780 0.017 . 1 . . 647 . A 85 ILE HD12 . 30684 1
735 . 1 . 1 85 85 ILE HD13 H 1 0.780 0.017 . 1 . . 647 . A 85 ILE HD13 . 30684 1
736 . 1 . 1 85 85 ILE C C 13 175.831 . . 1 . . 524 . A 85 ILE C . 30684 1
737 . 1 . 1 85 85 ILE CA C 13 61.422 0.014 . 1 . . 185 . A 85 ILE CA . 30684 1
738 . 1 . 1 85 85 ILE CB C 13 39.247 . . 1 . . 184 . A 85 ILE CB . 30684 1
739 . 1 . 1 85 85 ILE CG1 C 13 26.896 0.017 . 1 . . 443 . A 85 ILE CG1 . 30684 1
740 . 1 . 1 85 85 ILE CG2 C 13 17.868 . . 1 . . 591 . A 85 ILE CG2 . 30684 1
741 . 1 . 1 85 85 ILE CD1 C 13 13.946 0.019 . 1 . . 648 . A 85 ILE CD1 . 30684 1
742 . 1 . 1 85 85 ILE N N 15 125.218 . . 1 . . 66 . A 85 ILE N . 30684 1
743 . 1 . 1 86 86 SER H H 1 8.298 . . 1 . . 91 . A 86 SER H . 30684 1
744 . 1 . 1 86 86 SER HA H 1 4.595 0.002 . 1 . . 429 . A 86 SER HA . 30684 1
745 . 1 . 1 86 86 SER HB2 H 1 3.937 . . 2 . . 430 . A 86 SER HB2 . 30684 1
746 . 1 . 1 86 86 SER HB3 H 1 3.849 . . 2 . . 431 . A 86 SER HB3 . 30684 1
747 . 1 . 1 86 86 SER C C 13 173.137 . . 1 . . 523 . A 86 SER C . 30684 1
748 . 1 . 1 86 86 SER CA C 13 58.589 . . 1 . . 187 . A 86 SER CA . 30684 1
749 . 1 . 1 86 86 SER CB C 13 63.874 . . 1 . . 186 . A 86 SER CB . 30684 1
750 . 1 . 1 86 86 SER N N 15 119.257 . . 1 . . 92 . A 86 SER N . 30684 1
751 . 1 . 1 87 87 GLU H H 1 8.084 0.004 . 1 . . 59 . A 87 GLU H . 30684 1
752 . 1 . 1 87 87 GLU HA H 1 3.933 . . 1 . . 570 . A 87 GLU HA . 30684 1
753 . 1 . 1 87 87 GLU HB2 H 1 2.147 . . 2 . . 571 . A 87 GLU HB2 . 30684 1
754 . 1 . 1 87 87 GLU HB3 H 1 1.864 . . 2 . . 572 . A 87 GLU HB3 . 30684 1
755 . 1 . 1 87 87 GLU CA C 13 57.387 . . 1 . . 189 . A 87 GLU CA . 30684 1
756 . 1 . 1 87 87 GLU CB C 13 31.318 . . 1 . . 188 . A 87 GLU CB . 30684 1
757 . 1 . 1 87 87 GLU N N 15 127.482 . . 1 . . 60 . A 87 GLU N . 30684 1
stop_
save_